SCHEMBL11765786

SCHEMBL11765786

NCCCC[C@@H](NC(=O)[C@H](N)CC(N)=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.53
GSR P00390 1/20 0.49
CPB2 Q96IY4 7/20 0.44
ERAP2 Q6P179 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
LNPEP Q9UIQ6 1/20 0.43
SLC6A5 Q9Y345 1/20 0.42
NOD1 Q9Y239 1/20 0.42
SLC15A2 Q16348 1/20 0.42
GNPAT O15228 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
DPP7 Q9UHL4 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
SCHEMBL10700763 1.00 FOLH1 (0.53) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL5997604 1.00 FOLH1 (0.53) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL29376049 1.00 FOLH1 (0.53) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL14959945 1.00 FOLH1 (0.53) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL29663724 0.97 FOLH1 (0.50) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL30731558 0.97 FOLH1 (0.50) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL30714839 0.96 FOLH1 (0.52) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL30731559 0.94 FOLH1 (0.51) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL29960118 0.92 FOLH1 (0.46) FOLH1GSRCPB2ERAP2ERAP1
SCHEMBL30223699 0.91 FOLH1 (0.62) FOLH1GSRCPB2SLC6A5NOD1

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-4010260-A Derivatives of retro-enantio-somatostatin, intermediates therefor, and process therefor AYERST MCKENNA & HARRISON LTD. (CA) 1977-03-01 US disclosed