SCHEMBL7759091

SCHEMBL7759091

NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)N1CCCC1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.42
▸ DPP8 Q6V1X1 2/20 0.41
▸ DPP9 Q86TI2 2/20 0.41
▸ ACE P12821 8/20 0.41
▸ REN P00797 3/20 0.39
▸ LTA4H P09960 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PEPD P12955 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ACE2 Q9BYF1 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
SCHEMBL7759104 1.00 DPP4 (0.42) DPP4DPP8DPP9ACEREN
SCHEMBL4595209 0.96 DPP4 (0.44) DPP4DPP8DPP9ACEREN
SCHEMBL4595206 0.96 DPP4 (0.44) DPP4DPP8DPP9ACEREN
SCHEMBL5734357 0.96 DPP4 (0.44) DPP4DPP8DPP9ACEREN
SCHEMBL31618960 0.95 LTA4H (0.38) DPP4DPP8DPP9ACELTA4H
SCHEMBL10454951 0.92 TRHR (0.43) DPP4DPP8DPP9ACEREN
SCHEMBL10454953 0.92 TRHR (0.43) DPP4DPP8DPP9ACEREN
SCHEMBL29630526 0.89 TRHR (0.41) ACEACE2
SCHEMBL29590456 0.89 TRHR (0.41) ACEACE2
SCHEMBL678488 0.89 DPP4 (0.42) DPP4DPP8DPP9ACEREN

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-2001068114-A1 NOVEL PEPTIDES WITH ANTI-HYPERTENSIVE ACTIVITY MONSANTO COMPANY (US) 2001-09-20 — — WO disclosed
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