SCHEMBL5199459

SCHEMBL5199459

Cc1cccc(-c2[nH]c(C(C)C)nc2-c2cccc(-c3ccncc3)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 5/20 0.49
KDM4E B2RXH2 1/20 0.47
MTOR P42345 1/20 0.44
GSK3B P49841 1/20 0.43
MAPK14 Q16539 13/20 0.42
MAPK13 O15264 4/20 0.42
MAPK12 P53778 4/20 0.42
MAPK11 Q15759 4/20 0.42
GCGR P47871 1/20 0.42
RIPK2 O43353 1/20 0.40
ACVR1B P36896 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CSNK1D P48730 3/20 0.39
CSNK1E P49674 3/20 0.39
CYP2A6 P11509 1/20 0.39
RAF1 P04049 1/20 0.37
ALOX5 P09917 1/20 0.37

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
SCHEMBL5199866 0.89 TGFBR1 (0.48) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5199621 0.88 CYP2A6 (0.52) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5199441 0.87 TGFBR1 (0.47) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5201273 0.87 TGFBR1 (0.47) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5200754 0.86 TGFBR1 (0.47) TGFBR1KDM4EMTORMAPK14MAPK13
SCHEMBL5197675 0.86 TGFBR1 (0.46) TGFBR1KDM4EMTORMAPK14MAPK13
SCHEMBL5198045 0.86 KDM4E (0.47) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5199363 0.85 TGFBR1 (0.45) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5199899 0.85 TGFBR1 (0.45) TGFBR1KDM4EMTORMAPK14RIPK2
SCHEMBL5200006 0.85 TGFBR1 (0.45) TGFBR1KDM4EMTORMAPK14RIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275968-A1 Substituted Biphenyl Derivative SANKYO COMPANY, LIMITED (JP) 2007-11-29 US disclosed
EP-1798229-A1 SUBSTITUTED BIPHENYL DERIVATIVE Sankyo Company, Limited (JP) 2007-06-20 EP 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-20070275968-A1 Substituted Biphenyl Derivative COL2A1, COL1A1, FGFR3 TGFBR1 40/4885KDM4E 806/4885MTOR 3462/4885

“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.