SCHEMBL11568754

SCHEMBL11568754

CSCC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NOCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 3/20 0.47
CCKAR P32238 1/20 0.47
MME P08473 1/20 0.47
ANPEP P15144 1/20 0.47
LTA4H P09960 1/20 0.46
FNTA P49354 5/20 0.46
FNTB P49356 5/20 0.46
PGGT1B P53609 5/20 0.46

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
SCHEMBL29351192 0.87 CCKBR (0.51) CCKBRCCKARLTA4HFNTAFNTB
Hydrochloric Acid SCHEMBL11569026 0.86 CCKBR (0.51) CCKBRCCKARLTA4HFNTAFNTB
SCHEMBL30626304 0.85 BACE1 (0.55) FNTAFNTBPGGT1B
SCHEMBL11569657 0.85 CCKBR (0.62) CCKBRCCKAR
SCHEMBL11568069 0.84 CCKBR (0.64) CCKBRCCKAR
SCHEMBL29378966 0.84 FNTA (0.58) LTA4HFNTAFNTBPGGT1B
SCHEMBL8644611 0.82 FNTA (0.62) LTA4HFNTAFNTBPGGT1B
SCHEMBL8644625 0.82 FNTA (0.62) LTA4HFNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL11571082 0.82 LTA4H (0.45) MMELTA4H
SCHEMBL9597700 0.82 LTA4H (0.56) LTA4HFNTAFNTBPGGT1B

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
US-4172130-A α-AMINOACYL CONTAINING NEW PEPTIDES WITH GASTRIN EFFECTS AND A PROCESS FOR THE PREPARATION THEREOF RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1979-10-23 US disclosed