SCHEMBL6032028

SCHEMBL6032028

CC(C)(C)CNC(C(N)=O)C(=O)Nc1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 19/20 0.53
▸ PTGS2 P35354 1/20 0.47

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
SCHEMBL5628015 1.00 F10 (0.53) F10PTGS2
SCHEMBL5625949 1.00 F10 (0.53) F10PTGS2
SCHEMBL5628976 0.90 F10 (0.51) F10PTGS2
SCHEMBL5628067 0.90 F10 (0.51) F10PTGS2
SCHEMBL5627636 0.89 F10 (0.58) F10PTGS2
SCHEMBL5626393 0.89 F10 (0.58) F10PTGS2
SCHEMBL5627437 0.87 F10 (0.56) F10PTGS2
SCHEMBL5625539 0.87 F10 (0.56) F10PTGS2
SCHEMBL5625959 0.86 F10 (0.58) F10PTGS2
SCHEMBL5628024 0.86 F10 (0.58) F10PTGS2

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-1723164-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-11-22 — — EP disclosed
WO-2005095440-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-10-13 — — WO disclosed
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