SCHEMBL3661249

SCHEMBL3661249

Cc1nccc(-c2sc(C(N)=O)nc2C)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CDK2 P24941 12/20 0.47
CDK4 P11802 9/20 0.47
CCNE1 P24864 3/20 0.47
TGFBR1 P36897 1/20 0.41
PLK1 P53350 3/20 0.40
AURKA O14965 3/20 0.39
CDK7 P50613 3/20 0.39
CDK9 P50750 3/20 0.39
CDK1 P06493 2/20 0.39
PIK3CA P42336 6/20 0.38
PIK3CD O00329 4/20 0.38
PIK3CB P42338 4/20 0.38
PIK3CG P48736 4/20 0.38
AURKB Q96GD4 2/20 0.36
CCNA2 P20248 1/20 0.36

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
SCHEMBL3232487 0.83 PIK3CA (0.51) KDM4EGLAGAARAB9AL3MBTL1
SCHEMBL3237122 0.83 PIK3CA (0.52) KDM4EGLAGAARAB9AL3MBTL1
SCHEMBL3162020 0.83 PIK3CA (0.53) KDM4EGLAGAARAB9AL3MBTL1
SCHEMBL3663885 0.83 CDK4 (0.43) KDM4EGLAGAARAB9AL3MBTL1
SCHEMBL3232125 0.82 PIK3CA (0.43) CDK2CDK4CCNE1PLK1AURKA
SCHEMBL15653812 0.81 CDK2 (0.41) KDM4EGLAGAARAB9AL3MBTL1
SCHEMBL3665078 0.81 PIK3CA (0.52) CDK2CDK4CCNE1PLK1AURKA
SCHEMBL13358975 0.81 PIK3CA (0.45) CDK2CDK4CCNE1PLK1AURKA
SCHEMBL3232503 0.81 PIK3CA (0.53) KDM4ECDK2CDK4CCNE1PLK1
SCHEMBL3665996 0.80 PIK3CA (0.40) KDM4ECDK2CDK4CCNE1PLK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940771-B2 Organic compounds NOVARTIS AG (CH) 2015-01-27 US disclosed
EP-2240475-B1 THIAZOLE DERIVATIVES USED AS PI 3 KINASE INHIBITORS NOVARTIS AG (CH) 2013-09-25 EP disclosed
EP-2240475-A1 THIAZOLE DERIVATIVES USED AS PI 3 KINASE INHIBITORS Novartis AG (CH) 2010-10-20 EP disclosed
WO-2009080694-A1 THIAZOLE DERIVATIVES USED AS PI 3 KINASE INHIBITORS NOVARTIS AG (CH) 2009-07-02 WO disclosed
US-20090163469-A1 Organic Compounds NOVARTIS AG 2009-06-25 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 (1 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-20090163469-A1 Organic Compounds PIK3C3, PIK3CA, PIK3CD KDM4E 2761/4885GLA 1632/4885GAA 352/4885

“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.