SCHEMBL707268

SCHEMBL707268

Nc1ncc(CC(=O)Nc2cccc(F)c2)s1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
AURKA O14965 2/20 0.48
AURKB Q96GD4 1/20 0.47
PKM P14618 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
CDK8 P49336 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL4595357 0.88 SMN1; SMN2 (0.53) KMT2AMEN1SMN1; SMN2AURKAAURKB
SCHEMBL5027766 0.87 SMN1; SMN2 (0.46) KMT2AMEN1SMN1; SMN2L3MBTL1POLB
SCHEMBL5025349 0.85 L3MBTL1 (0.55) KMT2AMEN1L3MBTL1MAPTLMNA
SCHEMBL5025176 0.84 ALDH1A1 (0.48) KMT2AMEN1SMN1; SMN2MAPTLMNA
SCHEMBL5041435 0.83 AURKA (0.53) KMT2AMEN1SMN1; SMN2AURKAAURKB
SCHEMBL5025301 0.81 TSHR (0.53) KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL12523205 0.80 AURKA (0.51) KMT2AMEN1SMN1; SMN2AURKAAURKB
SCHEMBL5045422 0.80 KMT2A (0.46) KMT2AMEN1SMN1; SMN2PKML3MBTL1
SCHEMBL5027736 0.78 AURKA (0.49) KMT2AMEN1SMN1; SMN2AURKAAURKB
SCHEMBL6469861 0.77 MEN1 (0.57) KMT2AMEN1SMN1; SMN2PKML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238576-A1 Triazine Derivatives and their Therapeutical Applications CALIFORNIA CAPITAL EQUITY, LLC (CA) 2012-09-20 US disclosed
US-8124759-B2 Inhibitors of protein kinases ABBOTT LABORATORIES (US) 2012-02-28 US disclosed
EP-1899345-B1 PYRROLOTRIAZINE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-11-16 EP disclosed
EP-2150553-B1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF PROTEIN KINASES ABBOTT LAB (US) 2011-10-05 EP disclosed
EP-2297151-A1 INHIBITORS OF PROTEIN KINASES Abbott Laboratories (US) 2011-03-23 EP disclosed
WO-2010144338-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2010-12-16 WO disclosed
EP-2150553-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF PROTEIN KINASES Abbott Laboratories (US) 2010-02-10 EP disclosed
WO-2009136966-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (US) 2009-11-12 WO disclosed
US-20090131425-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (US) 2009-05-21 US disclosed
US-20090023743-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (IL) 2009-01-22 US disclosed
CN-1753889-A Quinazoline compounds ASTRAZENECA AB (SE) 2006-03-29 CN disclosed
US-20060058523-A1 Quinazoline compounds ASTRAZENECA AB (SE) 2006-03-16 US disclosed
US-20060046987-A1 Substituted quinazoline derivatives and their use as inhibitors ASTRAZENECA AB (SE) 2006-03-02 US disclosed
EP-1575946-A1 QUINAZOLINE COMPOUNDS AstraZeneca AB (SE) 2005-09-21 EP disclosed
US-6919338-B2 Substituted quinazoline derivatives and their use as inhibitors of aurora-2 kinase ASTRAZENECA AB (SE) 2005-07-19 US disclosed
WO-2004058752-A1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2004-07-15 WO disclosed
CN-1496364-A Substituted quinazoline derivatives and their use as inhibitors 2004-05-12 CN disclosed
US-20030187002-A1 Substituted quinazoline derivatives and their use as inhibitors ASTRAZENECA AB (SE) 2003-10-02 US disclosed
EP-1299381-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS AstraZeneca AB (SE) 2003-04-09 EP disclosed
WO-2002000649-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS ASTRAZENECA AB (SE) 2002-01-03 WO 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 (6 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-20090131425-A1 INHIBITORS OF PROTEIN KINASES AURKC, AURKB, PLK1 KMT2A 1632/4885MEN1 950/4885SMN1; SMN2 2414/4885
US-20060058523-A1 Quinazoline compounds NDUFS5, ABL1, NDUFS7 KMT2A 2083/4885MEN1 1897/4885SMN1; SMN2 1989/4885
US-20090023743-A1 INHIBITORS OF PROTEIN KINASES AURKC, AURKB, PLK1 KMT2A 1632/4885MEN1 950/4885SMN1; SMN2 2414/4885
US-20120238576-A1 Triazine Derivatives and their Therapeutical Applications SLC10A1, GLS, SLC10A2 KMT2A 2859/4885MEN1 3798/4885SMN1; SMN2 1360/4885
US-20060046987-A1 Substituted quinazoline derivatives and their use as inhibitors AURKA, AURKB, AURKC KMT2A 909/4885MEN1 1888/4885SMN1; SMN2 3417/4885
US-20030187002-A1 Substituted quinazoline derivatives and their use as inhibitors AURKA, AURKC, AURKB KMT2A 790/4885MEN1 2422/4885SMN1; SMN2 3412/4885

“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.