SCHEMBL14520566

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

nearest known ligand 0.64

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	17/20	0.64

▸	IL23R	Q5VWK5	3/20	0.63

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
SCHEMBL14520588	1.00	KISS1R (0.64)	KISS1RIL23R
SCHEMBL29400672	1.00	KISS1R (0.64)	KISS1RIL23R
SCHEMBL13367313	1.00	KISS1R (0.64)	KISS1RIL23R
SCHEMBL13460202	1.00	KISS1R (0.64)	KISS1RIL23R
SCHEMBL29400465	0.97	KISS1R (0.69)	KISS1RIL23R
SCHEMBL29403216	0.96	IL23R (0.66)	KISS1RIL23R
SCHEMBL12417309	0.95	IL23R (0.64)	KISS1RIL23R
SCHEMBL14498050	0.95	IL23R (0.64)	KISS1RIL23R
SCHEMBL13248726	0.94	KISS1R (0.66)	KISS1RIL23R
SCHEMBL12417315	0.94	KISS1R (0.65)	KISS1RIL23R

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
WO-2007065808-A2	NEUROPEPTIDE-2 RECEPTOR-AGONISTS	F. HOFFMANN-LA ROCHE AG (CH)	2007-06-14	—	—	WO	disclosed