SCHEMBL8243897

SCHEMBL8243897

C=CCNC(=O)C(=O)C(CCC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.39
▸ DPP8 Q6V1X1 2/20 0.39
▸ DPP9 Q86TI2 2/20 0.39
▸ FAP Q12884 1/20 0.39
▸ DPP7 Q9UHL4 1/20 0.39
▸ XIAP P98170 1/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ DPP3 Q9NY33 2/20 0.36
▸ F2 P00734 5/20 0.35
▸ F10 P00742 2/20 0.34
▸ PRSS1 P07477 2/20 0.34
▸ PLG P00747 1/20 0.34
▸ PRSS2 P07478 1/20 0.34
▸ PRSS3 P35030 1/20 0.34

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
SCHEMBL8280370 1.00 DPP4 (0.39) DPP4DPP8DPP9FAPDPP7
SCHEMBL8253477 0.95 DPP4 (0.38) DPP4DPP8DPP9FAPDPP7
SCHEMBL8247918 0.95 DPP4 (0.38) DPP4DPP8DPP9FAPDPP7
SCHEMBL8279416 0.91 PEPD (0.42) DPP4DPP8DPP9FAPDPP7
SCHEMBL8240611 0.89 DPP4 (0.38) DPP4DPP8DPP9FAPDPP7
SCHEMBL8240265 0.89 DPP4 (0.39) DPP4DPP8DPP9FAPDPP7
SCHEMBL8251134 0.89 PEPD (0.36) DPP4DPP8DPP9FAPDPP7
SCHEMBL8246714 0.88 ELANE (0.37) OPRM1
SCHEMBL8244610 0.88 ELANE (0.39) DPP4DPP8DPP9FAPDPP7
SCHEMBL8278695 0.88 ELANE (0.39) DPP4DPP8DPP9FAPDPP7

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730142-B1 NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS SCHERING CORP (US) 2011-06-29 — — EP disclosed
EP-1730110-B1 SULFUR COMPOUNDS AS INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE SCHERING CORP (US) 2010-06-09 — — EP disclosed
WO-2006130687-A2 LIVER/PLASMA CONCENTRATION RATIO FOR DOSING HEPATITIS C VIRUS PROTEASE INHIBITOR SCHERING CORPORATION (US) 2006-12-07 — — WO disclosed
WO-2006130553-A2 HCV PROTEASE INHIBITORS SCHERING CORPORATION (US) 2006-12-07 — — WO disclosed
WO-2006130628-A2 COMBINATION OF HCV PROTEASE INHIBITORS WITH A SURFACTANT SCHERING CORPORATION (US) 2006-12-07 — — WO disclosed
WO-2006130626-A2 METHOD FOR MODULATING ACTIVITY OF HCV PROTEASE THROUGH USE OF A NOVEL HCV PROTEASE INHIBITOR TO REDUCE DURATION OF TREATMENT PERIOD SCHERING CORPORATION (US) 2006-12-07 — — WO disclosed
WO-2006130554-A2 METHODS OF TREATING HEPATITIS C VIRUS SCHERING CORPORATION (US) 2006-12-07 — — WO disclosed
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