SCHEMBL6637082

SCHEMBL6637082

CC(C)OC(=O)[C@@](C)(C(=O)[C@H]1NC(C)(C)CS1)N(c1ccc(OC(=O)N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL6634282 0.91 HSD11B1 (0.31)
SCHEMBL6634581 0.90
SCHEMBL6633373 0.89 HSD11B1 (0.33)
SCHEMBL6633579 0.88 HSD11B1 (0.32)
SCHEMBL6633506 0.86
SCHEMBL6634386 0.85 CDK1 (0.32)
SCHEMBL6633406 0.85
SCHEMBL6636818 0.85 PGR (0.33)
SCHEMBL6635177 0.85 USP2 (0.32)
SCHEMBL6635534 0.85 ALDH1A1 (0.33)

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
EP-1000051-B1 CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 ELAN PHARM INC (US) 2004-05-19 EP claimed