SCHEMBL146914

SCHEMBL146914

Cc1cc(C)cc(Nc2nccc(-c3nc(N)sc3-c3ccccc3)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 9/20 0.52
SYK P43405 7/20 0.52
SRC P12931 6/20 0.52
ZAP70 P43403 6/20 0.52
KDR P35968 2/20 0.50
CDK4 P11802 6/20 0.49
PLK1 P53350 1/20 0.49
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
CCNE1 P24864 2/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
CDK5 Q00535 2/20 0.47
CDK5R1 Q15078 2/20 0.47
AURKA O14965 2/20 0.47
ABL1 P00519 2/20 0.47

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
SCHEMBL144871 0.81 ZAP70 (0.56) CDK2SYKSRCZAP70KDR
SCHEMBL5780635 0.79 KCNH2 (0.57) CDK2CDK4PLK1CCNE1ALDH1A1
SCHEMBL141036 0.79 CDK2 (0.53) CDK2SYKSRCZAP70KDR
SCHEMBL5781821 0.76 PIK3CG (0.60) CDK2SYKKDRCDK4FLT1
SCHEMBL2283342 0.75 CDK2 (0.77) CDK2SYKSRCKDRCDK4
SCHEMBL5779921 0.74 CCNT1 (0.51) CDK2SYKSRCCDK4PLK1
SCHEMBL5779291 0.74 KCNH2 (0.68) CDK2SYKCDK4PLK1CCNE1
SCHEMBL5781152 0.74 CDK4 (0.59) CDK2SYKSRCCDK4CCNE1
SCHEMBL5780393 0.74 CAMK2D (0.62) CDK2KDRCDK4PLK1CCNE1
SCHEMBL5779741 0.74 CCNT1 (0.53) CDK2SYKSRCCDK4PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040181066-A1 Tyrosine kinase inhibitors FRALEY MARK E (US) 2004-09-16 US claimed
WO-2003011838-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-13 WO claimed
US-20140221455-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR Verva Pharmaceuticals, Inc. (AU) 2014-08-07 US disclosed
US-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR VERVA PHARMACEUTICALS PTY LTD (AU) 2012-03-08 US disclosed
US-20050282733-A1 Differentiation modulating agents and uses therefor VERVA PHARMACEUTICALS PTY LTD (AU) 2005-12-22 US disclosed
WO-2005065686-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR ADIPOGEN PHARMACEUTICALS PTY LIMITED (AU) 2005-07-21 WO disclosed
US-20040181066-A1 Tyrosine kinase inhibitors FRALEY MARK E (US) 2004-09-16 US disclosed
WO-2003011838-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-13 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 (3 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-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR FGF1, FABP4, FGF2 CDK2 2042/4885SYK 4711/4885SRC 2611/4885
US-20050282733-A1 Differentiation modulating agents and uses therefor FGF1, FABP4, FGF2 CDK2 2042/4885SYK 4711/4885SRC 2611/4885
US-20040181066-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 CDK2 89/4885SYK 69/4885SRC 37/4885

“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.