SCHEMBL5006916

SCHEMBL5006916

CCOc1cc(C(Nc2ccc3c(N)nccc3c2)(OC(=O)C(F)(F)F)C(=O)NCc2cc(N)cc(NC(C)=O)c2)ccc1OC(C)C

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.55
F3 P13726 20/20 0.55
F10 P00742 16/20 0.55
F2 P00734 15/20 0.55
F11 P03951 12/20 0.55
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43

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
SCHEMBL5009038 0.97 F7 (0.56) F7F3F10F2F11
SCHEMBL5009099 0.93 F7 (0.64) F7F3F10F2F11
SCHEMBL4611942 0.90 F7 (0.62) F7F3F10F2F11
SCHEMBL4999339 0.88 F7 (0.55) F7F3F10F2F11
SCHEMBL5000126 0.88 F7 (0.57) F7F3F10F2F11
SCHEMBL4612467 0.87 F7 (0.55) F7F3F10F2F11
SCHEMBL5003304 0.87 F7 (0.55) F7F3F10F2F11
SCHEMBL2852885 0.87 F7 (0.66) F7F3F10F2F11
SCHEMBL5009067 0.87 F7 (0.56) F7F3F10F2F11
SCHEMBL5003585 0.86 F7 (0.53) F7F3F10F2F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed