SCHEMBL7510657

SCHEMBL7510657

COc1ccc(C#N)cc1Oc1nc(Oc2cccc(C(=O)N(C)C)c2)c(F)c(CNCC(=O)O)c1F

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.55
F2 P00734 8/20 0.48

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
SCHEMBL6576252 0.85 F10 (0.64) F10F2
SCHEMBL6580778 0.85 F10 (0.74) F10F2
SCHEMBL6581469 0.84 F10 (0.62) F10F2
SCHEMBL6578898 0.81 F10 (0.56) F10F2
SCHEMBL6775720 0.81 F10 (0.56) F10F2
SCHEMBL6576026 0.79 F10 (0.55) F10F2
SCHEMBL6579170 0.79 F10 (0.75) F10F2
SCHEMBL6581648 0.78 F10 (0.53) F10F2
SCHEMBL8341457 0.78 F10 (0.53) F10F2
SCHEMBL6579303 0.77 F10 (0.57) F10F2

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
EP-0813525-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1997-12-29 EP disclosed
WO-1996028427-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1996-09-19 WO disclosed