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SCHEMBL3834872

SCHEMBL3834872

COC(=O)Nc1ccc(S(=O)(=O)C(C)C)c(C2CCCN2C(=O)[C@H](Nc2cc(C)c3c(c2)C(=O)NC3)c2ccc(OC)c(OC)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 20/20 1.00
▸ F3 P13726 20/20 1.00
▸ PLG P00747 1/20 0.74

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
SCHEMBL2527336 1.00 F7 (1.00) F7F3PLG
SCHEMBL2528430 0.94 F7 (1.00) F7F3PLG
SCHEMBL12241604 0.93 F7 (0.87) F7F3PLG
SCHEMBL2528781 0.91 F7 (1.00) F7F3PLG
SCHEMBL2528779 0.91 F7 (1.00) F7F3PLG
SCHEMBL3832858 0.91 F7 (1.00) F7F3PLG
SCHEMBL12220232 0.90 F7 (0.82) F7F3PLG
SCHEMBL3068885 0.87 F7 (1.00) F7F3
SCHEMBL3068890 0.87 F7 (1.00) F7F3
SCHEMBL3093181 0.87 F7 (1.00) F7F3

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-2099783-A1 BICYCLIC LACTAM FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS Brystol-Myers Squibb Company (US) 2009-09-16 — — EP disclosed
WO-2008079759-A1 BICYCLIC LACTAM FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-07-03 — — WO disclosed