SCHEMBL16297751

SCHEMBL16297751

CCCC(N)C(=O)C(=O)NCC(=O)N[C@H](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
SCHEMBL8244173 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006113942-A2 METHOD OF INHIBITING CATHEPSIN ACTIVITY SCHERING CORPORATION (US) 2006-10-26 WO disclosed