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SCHEMBL6964185

SCHEMBL6964185

CCOC(=O)[C@H](CNC(=O)CNC(=O)C(CCC1CCN(C(=O)O)CC1)CCC1CCN(C(=O)OC(C)(C)C)CC1)NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 12/20 0.48
▸ MMP13 P45452 7/20 0.44
▸ MMP1 P03956 3/20 0.41
▸ MMP3 P08254 3/20 0.41
▸ MMP7 P09237 3/20 0.41
▸ MMP9 P14780 3/20 0.41
▸ MMP8 P22894 3/20 0.41
▸ MMP2 P08253 2/20 0.41
▸ LIMK2 P53671 1/20 0.40

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
SCHEMBL6964258 0.95 MMP13 (0.50) GPR119MMP13MMP1MMP3MMP7
SCHEMBL7951214 0.94 TGFBR1 (0.44) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6962633 0.94 MMP13 (0.49) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6963385 0.94 STS (0.46) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6968993 0.94 MMP13 (0.50) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6968735 0.92 ITGB3 (0.45) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6974989 0.91 GPR119 (0.42) GPR119MMP13MMP1MMP3MMP7
SCHEMBL6976930 0.90 TGFBR1 (0.45) MMP13
SCHEMBL6976329 0.90 F2 (0.44) GPR119MMP13
SCHEMBL6976888 0.89 GPR119 (0.41) GPR119MMP13MMP1MMP3MMP7

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-1098878-B1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS CEPHALON FRANCE (FR) 2003-12-17 — — EP disclosed
US-6333338-B1 ANTICOAGULANTS, CARDIOVASCULAR DISORDERS LABORATOIRE L. LAFON (FR) 2001-12-25 — — US disclosed