SCHEMBL5199443

SCHEMBL5199443

Cc1cccc(-c2[nH]c(C(C)C)nc2-c2ccc(F)c(-c3ccc(NC(=O)NC4CCN(C)CC4)cc3)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.50
KDM5B Q9UGL1 1/20 0.38
ATM Q13315 1/20 0.36
WNT1 P04628 1/20 0.36
DYRK1A Q13627 1/20 0.36
HTR1A P08908 1/20 0.36
HTR7 P34969 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
SCHEMBL5200577 0.90 TGFBR1 (0.53) TGFBR1ATMWNT1DYRK1A
SCHEMBL5229192 0.90 TGFBR1 (0.62) TGFBR1WNT1DYRK1A
SCHEMBL5197782 0.88 TGFBR1 (0.43) TGFBR1
SCHEMBL5228132 0.86 TGFBR1 (0.44) TGFBR1
SCHEMBL5198925 0.83 TGFBR1 (0.49) TGFBR1
SCHEMBL5228813 0.81 TGFBR1 (0.50) TGFBR1
SCHEMBL5222935 0.80 TGFBR1 (0.51) TGFBR1
SCHEMBL5197993 0.80 TGFBR1 (0.77) TGFBR1
SCHEMBL5226839 0.79 TGFBR1 (0.67) TGFBR1DYRK1A
SCHEMBL5197802 0.79 TGFBR1 (0.62) TGFBR1

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 40/4885KDM5B 275/4885ATM 4814/4885

“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.