SCHEMBL21397756

CSCC[C@H](NC(=O)CCO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	APLNR	P35414	2/20	0.47

▸	CTSL	P07711	3/20	0.45

▸	CTSS	P25774	3/20	0.45

▸	CTSK	P43235	3/20	0.45

▸	CTSH	P09668	1/20	0.45

▸	RXFP1	Q9HBX9	1/20	0.43

▸	CXCR4	P61073	1/20	0.42

▸	IL23R	Q5VWK5	2/20	0.41

▸	PTH1R	Q03431	1/20	0.41

▸	TLR2	O60603	1/20	0.41

▸	NPBWR1	P48145	1/20	0.41

▸	OPRL1	P41146	4/20	0.41

▸	MC4R	P32245	1/20	0.41

▸	MC5R	P33032	1/20	0.41

▸	MC3R	P41968	1/20	0.41

▸	MC1R	Q01726	1/20	0.41

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
SCHEMBL31694504	0.84	PTH1R (0.55)	APLNRRXFP1CXCR4IL23RPTH1R
SCHEMBL31437150	0.83	CTSL (0.47)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL14479383	0.82	TFPI (0.46)	APLNRCTSLCTSSCTSKCTSH
SCHEMBL31474897	0.81	APLNR (0.50)	APLNRTLR2NPBWR1
SCHEMBL30740007	0.81	APLNR (0.50)	APLNRTLR2NPBWR1
SCHEMBL31467761	0.81	SLC15A2 (0.46)	—
SCHEMBL29754616	0.81	NPY4R (0.45)	APLNR
SCHEMBL29614462	0.80	TFPI (0.46)	APLNRCTSLCTSSCTSKCTSH
SCHEMBL31437155	0.80	SLC15A2 (0.44)	APLNRCTSLCTSSCTSKCTSH
SCHEMBL11123257	0.80	C5AR1 (0.47)	APLNRCTSLCTSSCTSKCTSH

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-2019181235-A1	METHOD FOR PRODUCING LIPIDATED PROTEIN, AND LIPIDATED PROTEIN	国立大学法人九州大学	2019-09-26	—	—	WO	disclosed