SCHEMBL7455481

SCHEMBL7455481

COCC(=CC(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)N)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 1.00
PRSS1 P07477 3/20 0.63
F2 P00734 2/20 0.60
KCNH2 Q12809 1/20 0.60

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
SCHEMBL7455475 1.00 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7683937 1.00 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7690239 0.88 F10 (0.88) F10PRSS1F2KCNH2
SCHEMBL7681967 0.85 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7451947 0.85 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7451943 0.85 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7679990 0.85 F10 (0.73) F10PRSS1F2KCNH2
SCHEMBL7688502 0.85 F10 (0.73) F10PRSS1F2KCNH2
SCHEMBL7449244 0.83 F10 (1.00) F10PRSS1F2KCNH2
SCHEMBL7688506 0.81 F10 (0.81) F10PRSS1F2

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
EP-1189879-A1 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2002-03-27 EP disclosed
WO-2000071512-A1 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2000-11-30 WO disclosed