SCHEMBL1769361

SCHEMBL1769361

CN(C)CC1(c2ccc(N3CC(CNC(=O)c4ccc(Cl)s4)OC3=O)cc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.73
F2 P00734 2/20 0.62
ABCB11 O95342 1/20 0.62
ST14 Q9Y5Y6 1/20 0.62

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
SCHEMBL1769257 0.91 F10 (0.73) F10F2ABCB11ST14
SCHEMBL1769426 0.91 F10 (0.67) F10F2ABCB11ST14
SCHEMBL1769441 0.91 F10 (0.67) F10F2ABCB11ST14
SCHEMBL1769430 0.89 F10 (0.68) F10F2ABCB11ST14
SCHEMBL1769394 0.89 F10 (0.72) F10F2ABCB11ST14
SCHEMBL1769267 0.89 F10 (0.67) F10F2ABCB11ST14
SCHEMBL1769339 0.89 F10 (0.68) F10F2ABCB11ST14
SCHEMBL1769450 0.88 F10 (0.71) F10F2ABCB11ST14
SCHEMBL1769335 0.88 F10 (0.68) F10F2ABCB11ST14
SCHEMBL1769470 0.87 F10 (0.69) F10

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
WO-2011061760-A1 NOVEL ANTITHROMBOTIC AGENTS CADILA HEALTHCARE LIMITED (IN) 2011-05-26 WO claimed
WO-2011061760-A1 NOVEL ANTITHROMBOTIC AGENTS CADILA HEALTHCARE LIMITED (IN) 2011-05-26 WO disclosed