SCHEMBL11324402

CC(O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](CO)C(=O)N[C@@H](CS)C(=O)O)C(C)O

nearest known ligand 0.62

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	11/20	0.54

▸	C5AR1	P21730	2/20	0.53

▸	GHSR	Q92847	3/20	0.51

▸	UTS2R	Q9UKP6	1/20	0.49

▸	KISS1R	Q969F8	1/20	0.49

▸	PRMT1	Q99873	1/20	0.48

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
SCHEMBL11324441	1.00	IL23R (0.54)	IL23RC5AR1GHSRUTS2RKISS1R
SCHEMBL11430221	0.97	IL23R (0.58)	IL23RC5AR1KISS1R
SCHEMBL11427819	0.97	IL23R (0.55)	IL23RC5AR1
SCHEMBL11430235	0.97	IL23R (0.58)	IL23RC5AR1KISS1R
SCHEMBL11427833	0.97	IL23R (0.59)	IL23RC5AR1GHSR
SCHEMBL11411902	0.94	C5AR1 (0.58)	IL23RC5AR1
SCHEMBL11411927	0.94	C5AR1 (0.58)	IL23RC5AR1
SCHEMBL11420763	0.93	IL23R (0.59)	IL23RGHSRUTS2RKISS1RPRMT1
SCHEMBL11420715	0.93	IL23R (0.59)	IL23RGHSRUTS2RKISS1RPRMT1
SCHEMBL11525047	0.93	IL23R (0.54)	IL23RC5AR1GHSR

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-4253998-A	FOR USE AS A HORMONE INHIBITOR	AMERICAN HOME PRODUCTS CORPORATION (US)	1981-03-03	—	—	US	claimed