SCHEMBL19771595

CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CNC(=O)CC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(N)cc2)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O

nearest known ligand 0.76

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	OXTR	P30559	15/20	0.76

▸	AVPR1A	P37288	5/20	0.71

▸	AVPR2	P30518	4/20	0.69

▸	AVPR1B	P47901	4/20	0.69

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
SCHEMBL17150591	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL20458950	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19003816	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19771636	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19771598	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19771606	0.93	OXTR (0.87)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19771609	0.93	OXTR (0.80)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL19771620	0.93	OXTR (0.77)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL20459034	0.92	OXTR (0.84)	OXTRAVPR1AAVPR2AVPR1B
SCHEMBL17150807	0.92	OXTR (0.84)	OXTRAVPR1AAVPR2AVPR1B

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-9868766-B2	Peptides as oxytocin agonists	HOFFMANN-LA ROCHE INC. (US)	2018-01-16	—	—	US	disclosed