SCHEMBL13478176

CN[C@H](CC1CCCCC1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCCNC(=N)N)C(=O)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1F)NC(C)=O)C(=O)N1CCCC1C=O

nearest known ligand 0.47

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	2/20	0.47

▸	C5AR1	P21730	2/20	0.47

▸	MC4R	P32245	6/20	0.44

▸	MC5R	P33032	2/20	0.44

▸	MC3R	P41968	2/20	0.44

▸	MC1R	Q01726	2/20	0.44

▸	CTSL	P07711	3/20	0.44

▸	CTSS	P25774	3/20	0.44

▸	CTSK	P43235	3/20	0.44

▸	CXCR4	P61073	2/20	0.44

▸	CTSH	P09668	1/20	0.43

▸	CXCL8	P10145	4/20	0.42

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
SCHEMBL13144378	0.93	IL23R (0.53)	IL23RC5AR1MC4RMC5RMC3R
SCHEMBL13145228	0.92	CTSL (0.51)	IL23RC5AR1MC4RMC5RMC3R
SCHEMBL13144373	0.89	CXCL8 (0.49)	IL23RC5AR1CXCL8
SCHEMBL13739633	0.89	C5AR1 (0.50)	IL23RC5AR1MC4RMC5RMC3R
SCHEMBL13478184	0.88	C5AR1 (0.48)	IL23RC5AR1MC4RCTSLCTSS
SCHEMBL13478177	0.88	MC4R (0.55)	IL23RMC4RMC5RMC3RMC1R
SCHEMBL13144545	0.88	MC4R (0.55)	IL23RMC4RMC5RMC3RMC1R
SCHEMBL13144366	0.88	C5AR1 (0.51)	IL23RC5AR1MC4RMC5RMC3R
SCHEMBL13144533	0.87	C5AR1 (0.53)	IL23RC5AR1MC4RMC5RMC3R
SCHEMBL13478170	0.86	IL23R (0.54)	IL23RC5AR1MC4RMC5RMC3R

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-7659246-B2	Treatment of osteoarthritis	PROMICS PTY LIMITED (AU)	2010-02-09	—	—	US	disclosed