SCHEMBL3372792

SCHEMBL3372792

CC(C)N1CCC(NC(=O)Oc2nc3c(C(=O)N4CCCOCC4)scc3n2CC(=O)Nc2ccc(Cl)cn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.49
F2 P00734 3/20 0.49
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL1383480 0.89 F10 (0.55) F10F2
SCHEMBL3371161 0.89 F10 (0.53) F10F2
SCHEMBL3368811 0.86 F10 (0.51) F10F2HRH3
SCHEMBL3373066 0.86 F10 (0.55) F10F2
SCHEMBL6017044 0.84 F10 (0.45) F10F2
SCHEMBL3231945 0.81 F10 (0.55) F10F2HRH3
SCHEMBL3370026 0.79 ALDH1A1 (0.39) F10F2
SCHEMBL3371486 0.79 F10 (0.60) F10F2
SCHEMBL3372965 0.78 F10 (0.66) F10F2
SCHEMBL3374319 0.78 F10 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP claimed