SCHEMBL15511808

CC[C@H](C)C1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O

nearest known ligand 0.87

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	AVPR1A	P37288	6/20	0.87

▸	OXTR	P30559	15/20	0.85

▸	AVPR2	P30518	5/20	0.85

▸	AVPR1B	P47901	5/20	0.85

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
Nacartocin SCHEMBL15511773	0.96	AVPR1A (0.81)	AVPR1AOXTRAVPR2AVPR1B
SCHEMBL15511850	0.94	OXTR (0.88)	AVPR1AOXTRAVPR2AVPR1B
Demoxytocin SCHEMBL38442	0.93	AVPR1A (0.88)	AVPR1AOXTRAVPR2AVPR1B
Demoxytocin SCHEMBL29376547	0.93	AVPR1A (0.88)	AVPR1AOXTRAVPR2AVPR1B
SCHEMBL15511596	0.93	AVPR1A (1.00)	AVPR1AOXTRAVPR2AVPR1B
Demoxytocin SCHEMBL38443	0.93	AVPR1A (0.88)	AVPR1AOXTRAVPR2AVPR1B
Oxytocin Trisulfide SCHEMBL30712243	0.92	AVPR1A (0.86)	AVPR1AOXTRAVPR2AVPR1B
SCHEMBL20963084	0.92	AVPR1A (0.79)	AVPR1AOXTRAVPR2AVPR1B
SCHEMBL18651035	0.92	OXTR (1.00)	AVPR1AOXTRAVPR2AVPR1B
SCHEMBL19771602	0.92	OXTR (0.84)	AVPR1AOXTRAVPR2AVPR1B

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