SCHEMBL1366724

SCHEMBL1366724

COc1ccc(N(C)c2nc(NC(=O)C(C)(C)C)nc3[nH]c4ccccc4c23)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB3 Q13509 6/20 0.64
ABCB1 P08183 3/20 0.64
KDR P35968 5/20 0.47
PDGFRB P09619 3/20 0.46
EGFR P00533 4/20 0.43
LMNA P02545 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
PTK6 Q13882 1/20 0.41
TUBB4A P04350 3/20 0.40
TUBB P07437 3/20 0.40
TUBA3C P0DPH7 3/20 0.40
TUBA1B P68363 3/20 0.40
TUBA4A P68366 3/20 0.40
TUBB4B P68371 3/20 0.40
TUBB2A Q13885 3/20 0.40
TUBB8 Q3ZCM7 3/20 0.40
TUBA3E Q6PEY2 3/20 0.40
TUBA1A Q71U36 3/20 0.40
TUBA1C Q9BQE3 3/20 0.40
TUBB6 Q9BUF5 3/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1368125 0.90 KDR (0.54) TUBB3ABCB1KDRPDGFRBEGFR
SCHEMBL12144353 0.87 KDR (0.61) TUBB3ABCB1KDRPDGFRBEGFR
SCHEMBL1368180 0.80 KDR (0.62) TUBB3ABCB1KDRPDGFRBEGFR
SCHEMBL1367379 0.74 PDGFRB (0.58) KDRPDGFRBEGFRLMNAMAPT
SCHEMBL1368533 0.74 KDR (0.78) KDRPDGFRBEGFRPTK6MAPT
SCHEMBL12510338 0.74 PDGFRB (0.55) TUBB3ABCB1KDRPDGFRBEGFR
SCHEMBL12143409 0.74 PDGFRB (0.55) TUBB3ABCB1KDRPDGFRBEGFR
SCHEMBL2258644 0.72 EGFR (0.62) TUBB3KDRPDGFRBEGFRTUBB4A
SCHEMBL3117420 0.67 EGFR (0.68) TUBB3KDRPDGFRBEGFRTUBB4A
SCHEMBL3116208 0.67 EGFR (0.68) TUBB3KDRPDGFRBEGFRTUBB4A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11091500-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2021-08-17 US disclosed
US-10676483-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2020-06-09 US disclosed
EP-2310014-B1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF UNIV HOLY GHOST DUQUESNE (US) 2020-03-18 EP disclosed
US-20200017521-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2020-01-16 US disclosed
US-10464944-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2019-11-05 US disclosed
US-10414777-B2 Tricyclic compounds having antimitotic and/or antitumor activity and method of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2019-09-17 US disclosed
US-9987283-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2018-06-05 US disclosed
US-20180127434-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHOD OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2018-05-10 US disclosed
US-9802955-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2017-10-31 US disclosed
US-20170246170-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2017-08-31 US disclosed
US-20150252053-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2015-09-10 US disclosed
US-20150232477-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2015-08-20 US disclosed
US-9056869-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2015-06-16 US disclosed
US-9045489-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2015-06-02 US disclosed
US-20130096146-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2013-04-18 US disclosed
US-8309564-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2012-11-13 US disclosed
US-20110295002-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2011-12-01 US disclosed
US-20110288108-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF GANGJEE ALEEM (US) 2011-11-24 US disclosed
US-7982035-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2011-07-19 US disclosed
US-20090082374-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2009-03-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090082374-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF ABCG2, ABCC1, ABCB1 TUBB3 139/4885ABCB1 3/4885KDR 4107/4885
US-20200017521-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF PLK1, AURKC, TOP1 TUBB3 70/4885ABCB1 529/4885KDR 4822/4885
US-20110288108-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF ABCG2, ABCC1, ABCB1 TUBB3 139/4885ABCB1 3/4885KDR 4107/4885
US-10676483-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof PLK1, AURKC, TOP1 TUBB3 70/4885ABCB1 529/4885KDR 4822/4885
US-20150252053-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof ABCG2, ABCC1, ABCB1 TUBB3 139/4885ABCB1 3/4885KDR 4107/4885
US-20180127434-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHOD OF USE THEREOF ABCG2, ABCC1, ABCB1 TUBB3 101/4885ABCB1 3/4885KDR 4111/4885
US-20130096146-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof ABCG2, ABCC1, ABCB1 TUBB3 139/4885ABCB1 3/4885KDR 4107/4885
US-11091500-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof ABCC1, ABCB1, ABCG2 TUBB3 41/4885ABCB1 2/4885KDR 4154/4885
US-20150232477-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof ABCC1, ABCG2, TP53 TUBB3 44/4885ABCB1 4/4885KDR 4411/4885
US-10464944-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof ABCC1, ABCG2, TP53 TUBB3 44/4885ABCB1 4/4885KDR 4411/4885
US-20110295002-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF ABCG2, ABCC1, ABCB1 TUBB3 139/4885ABCB1 3/4885KDR 4107/4885
US-20170246170-A1 Tricyclic Compounds Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof ABCC1, ABCG2, TP53 TUBB3 44/4885ABCB1 4/4885KDR 4411/4885
US-10414777-B2 Tricyclic compounds having antimitotic and/or antitumor activity and method of use thereof ABCG2, ABCC1, ABCB1 TUBB3 101/4885ABCB1 3/4885KDR 4111/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.