SCHEMBL7688216

SCHEMBL7688216

C/C(=C(\F)C(=O)Nc1ccc(-c2ccccc2S(=O)(=O)NC(C)(C)C)cc1)c1cccc(C#N)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 1/20 0.57
PRSS1 P07477 1/20 0.57
KCNH2 Q12809 1/20 0.57

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
SCHEMBL7451638 1.00 F10 (0.59) F10F2PRSS1KCNH2
SCHEMBL7685986 0.86 F10 (0.59) F10F2PRSS1KCNH2
SCHEMBL7449386 0.83 F10 (0.57) F10PRSS1
SCHEMBL7486989 0.83 F10 (0.57) F10PRSS1
SCHEMBL7449389 0.83 F10 (0.57) F10PRSS1
SCHEMBL7691288 0.81 F10 (0.55) F10F2PRSS1KCNH2
SCHEMBL7506603 0.81 F10 (0.55) F10F2PRSS1KCNH2
SCHEMBL7489382 0.81 F10 (0.59) F10
SCHEMBL7448455 0.81 F10 (0.59) F10
SCHEMBL7448459 0.81 F10 (0.59) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6399627-B1 ANTICOAGULANTS; PROTHROMINASE, SERINE PROTEASE INHIBITOR; ACRYLAMIDE DERIVATIVES COR THERAPEUTICS, INC. 2002-06-04 US disclosed
EP-1159264-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2001-12-05 EP disclosed
WO-2000047554-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS INC. (US) 2000-08-17 WO disclosed