SCHEMBL5630596

SCHEMBL5630596

COC[C@@H]1C[C@@H](NC(=O)c2ccc(-n3ccccc3=O)cc2)[C@H](NC(=O)c2ccc(Cl)s2)C1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.81
▸ F2 P00734 4/20 0.73
▸ F11 P03951 3/20 0.73

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
SCHEMBL5437796 1.00 F10 (0.81) F10F2F11
SCHEMBL5632088 0.92 F10 (0.77) F10F2F11
SCHEMBL5432475 0.92 F10 (0.77) F10F2F11
SCHEMBL14490791 0.90 F10 (1.00) F10F2F11
SCHEMBL5631281 0.89 F10 (0.81) F10F2F11
SCHEMBL5445529 0.89 F10 (0.81) F10F2F11
SCHEMBL5435821 0.89 F10 (0.81) F10F2F11
SCHEMBL5629910 0.89 F10 (0.81) F10F2F11
SCHEMBL5432520 0.88 F10 (1.00) F10F2F11
SCHEMBL5630242 0.87 F10 (0.82) F10F2F11

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
US-7205318-B2 Lactam-containing cyclic diamines and derivatives as a factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 — — US claimed
US-7205318-B2 Lactam-containing cyclic diamines and derivatives as a factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 — — US disclosed
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