SCHEMBL7850360

SCHEMBL7850360

CN(C(=O)C(N)Cc1ccccc1)C(CCCN)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
MC4R P32245 4/20 0.48
MC5R P33032 3/20 0.48
MC3R P41968 3/20 0.48
MMP2 P08253 2/20 0.44
LTA4H P09960 1/20 0.43
SLC1A3 P43003 2/20 0.41
SLC1A2 P43004 2/20 0.41
SLC1A1 P43005 2/20 0.41
SLC15A1 P46059 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
GRIK1 P39086 1/20 0.41
ANPEP P15144 1/20 0.40
RNPEP Q9H4A4 1/20 0.40
DNPEP Q9ULA0 1/20 0.40

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
SCHEMBL29641523 0.90 SLC7A5 (0.52) SLC7A5MC4RMC5RMC3RITGB3
SCHEMBL29909939 0.90 SLC7A5 (0.52) SLC7A5MC4RMC5RMC3RITGB3
SCHEMBL7907904 0.90 ALPI (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7857948 0.89 ITGB3 (0.41) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL8174915 0.83 MC4R (0.47) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL29641630 0.83 ITGB3 (0.50) MC4RMC5RMC3RITGB3ITGA2B
SCHEMBL7857054 0.83 MMP2 (0.50) MC4RMC5RMC3RMMP2SLC1A2
SCHEMBL29641711 0.83 ITGB3 (0.50) MC4RMC5RMC3RITGB3ITGA2B
SCHEMBL27920904 0.83 MC4R (0.52) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL27920888 0.83 MC4R (0.52) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed