SCHEMBL31688331

CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	APLNR	P35414	2/20	0.58

▸	C5AR1	P21730	1/20	0.58

▸	CXCR4	P61073	5/20	0.56

▸	EPHA2	P29317	2/20	0.55

▸	MC4R	P32245	1/20	0.55

▸	CTSL	P07711	2/20	0.52

▸	CTSS	P25774	2/20	0.52

▸	CTSK	P43235	2/20	0.52

▸	CTSH	P09668	1/20	0.52

▸	F2	P00734	1/20	0.52

▸	NMUR2	Q9GZQ4	1/20	0.52

▸	NMUR1	Q9HB89	1/20	0.52

▸	KEAP1	Q14145	1/20	0.52

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
SCHEMBL38665603	0.90	EPHA2 (0.60)	CXCR4EPHA2NMUR2NMUR1
SCHEMBL30576961	0.90	RAMP3 (0.59)	APLNRC5AR1CXCR4
SCHEMBL31688333	0.89	APLNR (0.65)	APLNRC5AR1MC4RF2
SCHEMBL30423484	0.88	GLP1R (0.60)	KEAP1
SCHEMBL30495678	0.87	C5AR1 (0.66)	APLNRC5AR1CXCR4MC4R
SCHEMBL29362632	0.86	APLNR (0.61)	APLNRC5AR1MC4RF2NMUR2
SCHEMBL30974573	0.86	C5AR1 (0.57)	APLNRC5AR1CXCR4MC4RCTSL
SCHEMBL29995500	0.86	APLNR (0.63)	APLNRC5AR1CXCR4MC4RNMUR2
SCHEMBL29599996	0.86	APLNR (0.63)	APLNRC5AR1CXCR4MC4RNMUR2
SCHEMBL30930534	0.86	F2 (0.60)	APLNRC5AR1EPHA2CTSLCTSS

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-20250297282-A1	VIRAL-BINDING PROTEIN AND RELATED REAGENTS, ARTICLES, AND METHODS OF USE	JUNO THERAPEUTICS GMBH (DE)	2025-09-25	—	—	US	disclosed