SCHEMBL15911526

SCHEMBL15911526

COc1ccc(C#N)c2c1c(C#N)c(OC(=O)NC1CCN(C(C)C)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 1/20 0.53
KLK1 P06870 1/20 0.53

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
SCHEMBL1675144 0.91 F10 (0.70) F10F2KLK1
SCHEMBL15911627 0.85 F10 (0.59) F10F2KLK1
SCHEMBL3836939 0.83 F10 (0.67) F10F2KLK1
SCHEMBL15911393 0.83 F10 (0.81) F10F2KLK1
SCHEMBL15911528 0.83 F10 (0.80) F10F2KLK1
SCHEMBL15911451 0.82 F10 (0.63) F10F2KLK1
SCHEMBL3837650 0.80 F10 (0.60) F10F2KLK1
SCHEMBL3835615 0.79 F10 (0.66) F10F2KLK1
SCHEMBL15911488 0.79 F10 (0.65) F10F2KLK1
SCHEMBL4607808 0.79 F10 (0.60) F10F2KLK1

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-1451185-B1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2014-08-06 EP claimed