SCHEMBL9145455

SCHEMBL9145455

C[C@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@]1(C(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.40
LTA4H P09960 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39

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
SCHEMBL7353043 0.85 PPIA (0.42) PPIA
SCHEMBL11453410 0.78 MAPT (0.41)
SCHEMBL11644105 0.78 PPARG (0.40)
SCHEMBL11445398 0.77 TRPV1 (0.37) PPIA
SCHEMBL10956390 0.73
SCHEMBL9142173 0.70 LTA4H (0.44) PPIALTA4H
SCHEMBL7384673 0.70 PPIA (0.41) PPIA
SCHEMBL1295583 0.69 PREP (0.54)
SCHEMBL1956708 0.69 MEN1 (0.38) PPIA
SCHEMBL9284204 0.69 HTT (0.42) DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7067638-A None JP disclosed
JP-H0767638-A NEW PROLYL ENDOPEPTIDASE AND ITS PRODUCTION MURAO SAWAO 1995-03-14 JP disclosed
JP-H00767638-A 0001-01-01 JP disclosed