SCHEMBL5197993

SCHEMBL5197993

Cc1cccc(-c2[nH]c(C(C)C)nc2-c2ccc(F)c(-c3ccc(C(=O)NC4CCOCC4)cc3)c2)n1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 7/20 0.77
KDR P35968 3/20 0.45
MAPK14 Q16539 2/20 0.41
GABRA5 P31644 6/20 0.40
HDAC4 P56524 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CNR2 P34972 1/20 0.39
GSK3B P49841 1/20 0.38
KCNH2 Q12809 1/20 0.38
CCNT1 O60563 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CDK9 P50750 1/20 0.37
EIF4E P06730 1/20 0.37
MAPK1 P28482 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
SCHEMBL5229192 0.90 TGFBR1 (0.62) TGFBR1MAPK14HDAC4HDAC6CDK2
SCHEMBL5199606 0.90 TGFBR1 (0.82) TGFBR1KDRMAPK14GABRA5HDAC4
SCHEMBL5197802 0.89 TGFBR1 (0.62) TGFBR1KDRMAPK1
SCHEMBL6222961 0.87 TGFBR1 (1.00) TGFBR1KDRMAPK14
SCHEMBL5197598 0.86 TGFBR1 (0.57) TGFBR1MAPK14
SCHEMBL5200669 0.83 TGFBR1 (0.51) TGFBR1KDRMAPK14
SCHEMBL5222935 0.81 TGFBR1 (0.51) TGFBR1MAPK14HDAC6
SCHEMBL5228813 0.80 TGFBR1 (0.50) TGFBR1
SCHEMBL5199443 0.80 TGFBR1 (0.50) TGFBR1
SCHEMBL5198595 0.80 TGFBR1 (0.48) TGFBR1MAPK14MAPK1

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 40/4885KDR 1163/4885MAPK14 2998/4885

“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.