SCHEMBL5197656

SCHEMBL5197656

Cc1cccc(-c2[nH]c(C(C)C)nc2-c2cccc(-c3ccc(NC(=O)NN4CCOCC4)cc3)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 7/20 0.52
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CDK2 P24941 3/20 0.41
CCNA2 P20248 2/20 0.41
CCNA1 P78396 2/20 0.41
CDK5 Q00535 2/20 0.41
CDK5R1 Q15078 2/20 0.41
PSEN1 P49768 7/20 0.40
PSEN2 P49810 7/20 0.40
APH1B Q8WW43 7/20 0.40
NCSTN Q92542 7/20 0.40
APH1A Q96BI3 7/20 0.40
PSENEN Q9NZ42 7/20 0.40
PIK3CA P42336 1/20 0.40
MTOR P42345 1/20 0.40
PIK3CG P48736 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 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
SCHEMBL5198925 0.90 TGFBR1 (0.49) TGFBR1NPC1RAB9ASMN1; SMN2CDK2
SCHEMBL5198378 0.89 TGFBR1 (0.61) TGFBR1SMN1; SMN2MTORMAPK14
SCHEMBL5200098 0.87 TGFBR1 (0.49) TGFBR1NPC1RAB9ASMN1; SMN2CDK2
SCHEMBL5199224 0.83 TGFBR1 (0.50) TGFBR1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5200004 0.82 TGFBR1 (0.44) TGFBR1MTORMAPK14
SCHEMBL5200577 0.82 TGFBR1 (0.53) TGFBR1
SCHEMBL5197782 0.81 TGFBR1 (0.43) TGFBR1CDK2MEN1KMT2ACCNE2
SCHEMBL5201026 0.81 TGFBR1 (0.49) TGFBR1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5200616 0.80 TGFBR1 (0.47) TGFBR1MTORMAPK14
SCHEMBL5200634 0.79 TGFBR1 (0.54) TGFBR1NPC1RAB9ASMN1; SMN2MAPK14

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 4 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 claimed
EP-1798229-A1 SUBSTITUTED BIPHENYL DERIVATIVE Sankyo Company, Limited (JP) 2007-06-20 EP claimed
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 40/4885NPC1 4055/4885RAB9A 1676/4885

“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.