SCHEMBL15929992

SCHEMBL15929992

CC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 11/20 0.65
OPRM1 P35372 1/20 0.59
OPRD1 P41143 1/20 0.59
NPY1R P25929 1/20 0.59
NPY2R P49146 1/20 0.59
NPY4R P50391 1/20 0.59

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
SCHEMBL30122986 0.89 KISS1R (0.61) KISS1ROPRM1OPRD1
SCHEMBL30418018 0.89 OPRM1 (0.59) KISS1ROPRM1OPRD1NPY1RNPY2R
SCHEMBL29539941 0.88 ERAP1 (0.64) OPRM1OPRD1
SCHEMBL29587170 0.88 KISS1R (0.67) KISS1R
SCHEMBL24915845 0.86 NPY1R (0.61) NPY1RNPY2RNPY4R
SCHEMBL24915284 0.86 NPY1R (0.61) NPY1RNPY2RNPY4R
SCHEMBL31488633 0.86 KISS1R (0.66) KISS1R
SCHEMBL11645760 0.86 IL1RN (0.66) KISS1R
SCHEMBL30799782 0.86 NPY1R (0.63) NPY1RNPY2RNPY4R
SCHEMBL19308274 0.85 OPRM1 (0.67) OPRM1OPRD1NPY1RNPY2RNPY4R

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-2014118318-A1 KISS1R RECEPTOR AGONIST COMPOUNDS AND USE THEREOF FOR INDUCING OVULATION IN MAMMALS INSTITUT NATIONAL DE LA RECHERCHE AGRONOMIQUE (FR) 2014-08-07 WO disclosed