SCHEMBL6988053

SCHEMBL6988053

CS(=O)(=O)c1c(-c2ccccc2)ccc(N2CCCC(C(=O)NC(=O)c3ccccc3)C2=O)c1F.O=S(=O)(O)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.46
FPR1 P21462 4/20 0.41
FPR2 P25090 4/20 0.41

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
SCHEMBL4680928 0.85 F10 (0.65) F10FPR2
SCHEMBL6988052 0.80 F10 (0.58) F10FPR1FPR2
SCHEMBL6988357 0.80 F10 (0.64) F10
SCHEMBL6988509 0.78 F10 (0.61) F10
SCHEMBL5914269 0.78 F10 (0.73) F10
SCHEMBL6985267 0.78 FPR2 (0.55) F10FPR1FPR2
SCHEMBL27677798 0.77 F10 (0.71) F10
SCHEMBL6987862 0.77 F10 (0.54) F10FPR1FPR2
SCHEMBL6988797 0.74 F10 (0.44) F10FPR1FPR2
SCHEMBL6988559 0.74 FPR2 (0.50) F10FPR1FPR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1337251-A1 MONOCYCLIC OR BICYCLIC CARBOCYCLES AND HETEROCYCLES AS FACTOR XA INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2003-08-27 EP claimed
WO-2002102380-A1 MONOCYCLIC OR BICYCLIC CARBOCYCLES AND HETEROCYCLES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-12-27 WO claimed
EP-1337251-A1 MONOCYCLIC OR BICYCLIC CARBOCYCLES AND HETEROCYCLES AS FACTOR XA INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2003-08-27 EP disclosed
WO-2002102380-A1 MONOCYCLIC OR BICYCLIC CARBOCYCLES AND HETEROCYCLES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-12-27 WO disclosed