SCHEMBL1366483

SCHEMBL1366483

CC(C)(C)C(=O)Nc1nc2[nH]c3cccc(Cl)c3c2c(=O)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.57
KDR P35968 5/20 0.56
EGFR P00533 3/20 0.56
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PARP1 P09874 2/20 0.43
MAOB P27338 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
CHEK1 O14757 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GRIN2D O15399 2/20 0.39
GRIN3B O60391 2/20 0.39

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
SCHEMBL12620149 0.88 SMN1; SMN2 (0.46) PDGFRBKDREGFRALDH1A1HPGD
SCHEMBL1369022 0.82 ALDH1A1 (0.45) PDGFRBKDREGFRALDH1A1HPGD
SCHEMBL31108170 0.79 PDGFRB (0.71) PDGFRBKDREGFRALDH1A1HPGD
SCHEMBL1367826 0.79 PDGFRB (0.71) PDGFRBKDREGFRALDH1A1HPGD
SCHEMBL14871018 0.78 PARP1 (0.47) PDGFRBKDREGFRPARP1MAOB
SCHEMBL30588970 0.72 TYMS (0.61) KDREGFRPARP1CHEK1GRIN2D
SCHEMBL1367742 0.72 TYMS (0.61) KDREGFRPARP1CHEK1GRIN2D
SCHEMBL13915414 0.71 SMN1; SMN2 (0.46) PDGFRBALDH1A1HPGDSMN1; SMN2ADORA2A
SCHEMBL13539588 0.70 POLB (0.47) ALDH1A1HPGDSMN1; SMN2ADORA2AADORA1
SCHEMBL9891925 0.70 GRIN2D (0.46) ALDH1A1HPGDSMN1; SMN2NR2E3GRIN2D

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 58 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
US-10654858-B2 Tricyclic compounds having cytostatic and/or cytotoxic activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2020-05-19 US disclosed
US-10654858-B2 Tricyclic compounds having cytostatic and/or cytotoxic activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2020-05-19 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-20190211019-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY GHOST 2019-07-11 US disclosed
US-20190211019-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY GHOST 2019-07-11 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-20110207757-A1 Tricyclic Compounds Having Cytostatic and/or Cytoxic Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2011-08-25 US disclosed
US-20110207757-A1 Tricyclic Compounds Having Cytostatic and/or Cytoxic Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2011-08-25 US disclosed
US-20110207757-A1 Tricyclic Compounds Having Cytostatic and/or Cytoxic Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2011-08-25 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-7960400-B2 Tricyclic compounds having cytostatic and/or cytotoxic activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2011-06-14 US disclosed
US-7960400-B2 Tricyclic compounds having cytostatic and/or cytotoxic activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2011-06-14 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
US-20090062318-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY GHOST 2009-03-05 US disclosed
US-20090062318-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DUQUESNE UNIVERSITY OF THE HOLY GHOST 2009-03-05 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 (11 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 PDGFRB 4281/4885KDR 4107/4885EGFR 3072/4885
US-20200017521-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF PLK1, AURKC, TOP1 PDGFRB 4770/4885KDR 4822/4885EGFR 3430/4885
US-20110288108-A1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF ABCG2, ABCC1, ABCB1 PDGFRB 4281/4885KDR 4107/4885EGFR 3072/4885
US-10676483-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof PLK1, AURKC, TOP1 PDGFRB 4770/4885KDR 4822/4885EGFR 3430/4885
US-20090062318-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DHFR, TK1, TYMS PDGFRB 586/4885KDR 46/4885EGFR 334/4885
US-11091500-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof ABCC1, ABCB1, ABCG2 PDGFRB 3869/4885KDR 4154/4885EGFR 2114/4885
US-10464944-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof ABCC1, ABCG2, TP53 PDGFRB 4450/4885KDR 4411/4885EGFR 3140/4885
US-20190211019-A1 TRICYCLIC COMPOUNDS HAVING CYTOSTATIC AND/OR CYTOTOXIC ACTIVITY AND METHODS OF USE THEREOF DHFR, TK1, TYMS PDGFRB 586/4885KDR 46/4885EGFR 334/4885
US-10414777-B2 Tricyclic compounds having antimitotic and/or antitumor activity and method of use thereof ABCG2, ABCC1, ABCB1 PDGFRB 4264/4885KDR 4111/4885EGFR 3276/4885
US-20110207757-A1 Tricyclic Compounds Having Cytostatic and/or Cytoxic Activity and Methods of Use Thereof DHFR, TK1, TK2 PDGFRB 606/4885KDR 42/4885EGFR 327/4885
US-10654858-B2 Tricyclic compounds having cytostatic and/or cytotoxic activity and methods of use thereof DHFR, TK1, TYMS PDGFRB 586/4885KDR 46/4885EGFR 334/4885

“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.