SCHEMBL15512342

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)C=S)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O

nearest known ligand 0.53

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	4/20	0.52

▸	NMUR2	Q9GZQ4	1/20	0.52

▸	NMUR1	Q9HB89	1/20	0.52

▸	MAPK8	P45983	1/20	0.51

▸	MAPK9	P45984	1/20	0.51

▸	MAPK10	P53779	1/20	0.51

▸	OXTR	P30559	3/20	0.51

▸	CALCR	P30988	4/20	0.50

▸	NTSR1	P30989	1/20	0.50

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.

Compound	similarity	top predicted	shared targets
SCHEMBL30445290	0.84	OPRD1 (0.59)	OPRD1CALCRNTSR1
SCHEMBL14060698	0.82	NPY1R (0.55)	OPRD1CALCRNTSR1
SCHEMBL30921603	0.82	OXTR (0.59)	OPRD1OXTRNTSR1
SCHEMBL31387945	0.82	CALCR (0.62)	OPRD1MAPK8MAPK9MAPK10CALCR
SCHEMBL30423827	0.82	NMUR2 (0.57)	OPRD1NMUR2NMUR1
SCHEMBL29611692	0.82	NPY1R (0.62)	OPRD1NMUR2NMUR1NTSR1
SCHEMBL20707335	0.82	NPY1R (0.62)	OPRD1NMUR2NMUR1NTSR1
SCHEMBL29612137	0.82	NPY1R (0.62)	OPRD1NMUR2NMUR1NTSR1
SCHEMBL29612082	0.82	NPY1R (0.62)	OPRD1NMUR2NMUR1NTSR1
SCHEMBL29611985	0.82	NPY1R (0.62)	OPRD1NMUR2NMUR1NTSR1

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20140066373-A1	TREATING DIABETES WITH OXYTOCIN OR OXYTOCIN ANALOGS	ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US)	2014-03-06	—	—	US	disclosed