SCHEMBL8286109

SCHEMBL8286109

CC(C)N1CCC(N2CCC[C@H](N(CN)S(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.46
F2 P00734 1/20 0.43
F9 P00740 1/20 0.43
PLAT P00750 1/20 0.43
KLKB1 P03952 1/20 0.43

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
SCHEMBL4627767 0.92 F10 (0.46) F10F2F9PLATKLKB1
SCHEMBL4627765 0.92 F10 (0.46) F10F2F9PLATKLKB1
SCHEMBL4627153 0.90 F10 (0.59) F10F2F9PLATKLKB1
SCHEMBL4626069 0.90 F10 (0.58) F10F2F9PLATKLKB1
SCHEMBL4627738 0.90 F10 (0.58) F10F2F9PLATKLKB1
SCHEMBL4627771 0.89 F10 (0.46) F10F2F9PLATKLKB1
SCHEMBL4627769 0.89 F10 (0.46) F10F2F9PLATKLKB1
SCHEMBL4626266 0.87 F10 (0.56) F10F2F9PLATKLKB1
SCHEMBL4626260 0.87 F10 (0.56) F10F2F9PLATKLKB1
SCHEMBL4625773 0.87 F10 (0.55) F10F2F9PLATKLKB1

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
WO-2005048922-A2 SULFONYLAMINOVALEROLACTAMS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-06-02 WO disclosed