SCHEMBL10378604

CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N(N)C(=O)c1ccccc1.CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NC(=O)N1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	NPY4R	P50391	7/20	0.38

▸	NPY1R	P25929	5/20	0.38

▸	NPY2R	P49146	4/20	0.38

▸	NPY5R	Q15761	4/20	0.38

▸	IL23R	Q5VWK5	2/20	0.37

▸	KDM1A	O60341	3/20	0.37

▸	MAOB	P27338	1/20	0.37

▸	KDM5A	P29375	1/20	0.37

▸	KDM1B	Q8NB78	1/20	0.37

▸	KEAP1	Q14145	1/20	0.36

▸	OPRL1	P41146	2/20	0.36

▸	CXCR4	P61073	1/20	0.36

▸	TFPI	P10646	1/20	0.35

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
SCHEMBL10378943	0.90	NPY4R (0.45)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10435107	0.89	NPY4R (0.41)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10378229	0.87	NPY4R (0.42)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10434878	0.80	ITGB3 (0.39)	—
SCHEMBL10376823	0.77	NPY4R (0.45)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10378608	0.77	NPY4R (0.46)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10434863	0.77	NPY4R (0.43)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL10378603	0.77	NPY4R (0.41)	NPY4RNPY1RNPY2RNPY5RKDM1A
SCHEMBL9551261	0.76	BACE1 (0.55)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL10378948	0.75	NPY4R (0.46)	NPY4RNPY1RNPY2RNPY5RIL23R

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-1990003180-A1	PEPTIDES HAVING T CELL SUPPRESSOR ACTIVITY	IMMUNOBIOLOGY RESEARCH INSTITUTE, INC. (US)	1990-04-05	—	—	WO	disclosed