SCHEMBL8244173

SCHEMBL8244173

CCCC(N)C(=O)C(=O)NCC(=O)NC(C(N)=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 6/20 0.45
ANPEP P15144 1/20 0.40
RNPEP Q9H4A4 1/20 0.40
DNPEP Q9ULA0 1/20 0.40
GPR139 Q6DWJ6 4/20 0.40
POLB P06746 1/20 0.39
SLC6A9 P48067 1/20 0.37
F7 P08709 3/20 0.37
F2 P00734 1/20 0.37

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
SCHEMBL16297751 1.00 GPR88 (0.45) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL16297776 0.92 ATM (0.43) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8242542 0.92 ATM (0.43) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8239737 0.91 ANPEP (0.43) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL16297806 0.91 ANPEP (0.43) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL16297768 0.88 GPR88 (0.46) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8246550 0.88 GPR88 (0.46) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8245719 0.88 MMP2 (0.47) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8184380 0.87 GPR88 (0.45) GPR88ANPEPRNPEPDNPEPGPR139
SCHEMBL8239631 0.87 GPR88 (0.45) GPR88ANPEPRNPEPDNPEPGPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385870-B1 PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORP (US) 2010-03-17 EP disclosed
WO-2006130686-A2 HCV PROTEASE INHIBITORS IN COMBINATION WITH FOOD SCHERING CORPORATION (US) 2006-12-07 WO 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-2006130552-A2 METHODS OF TREATING HEPATITIS C VIRUS SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130607-A2 CONTROLLED-RELEASE FORMULATION USEFUL FOR TREATING DISORDERS ASSOCIATED WITH HEPATITIS C VIRUS 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-2006130688-A2 COMPOUNDS FOR INHIBITING CATHEPSIN ACTIVITY 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
WO-2003062265-A2 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2003-07-31 WO disclosed