SCHEMBL30883238

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.63

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	CTSL	P07711	3/20	0.63

▸	CTSS	P25774	3/20	0.63

▸	CTSK	P43235	3/20	0.63

▸	CTSH	P09668	1/20	0.63

▸	C5AR1	P21730	1/20	0.60

▸	CXCR4	P61073	10/20	0.58

▸	NMBR	P28336	2/20	0.56

▸	GRPR	P30550	2/20	0.56

▸	APLNR	P35414	1/20	0.55

▸	NPY1R	P25929	1/20	0.54

▸	NPY2R	P49146	1/20	0.54

▸	NPY4R	P50391	1/20	0.54

▸	NPY5R	Q15761	1/20	0.54

▸	GLP1R	P43220	1/20	0.54

▸	GCGR	P47871	1/20	0.54

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
SCHEMBL30988892	0.96	CTSL (0.63)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29965030	0.86	C5AR1 (0.74)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30883203	0.86	NPY1R (0.65)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30091430	0.85	CTSL (0.67)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL31506622	0.85	DPP3 (0.61)	CTSLCTSSCTSKCTSHCXCR4
SCHEMBL29697166	0.85	CTSL (0.62)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30262205	0.85	CTSL (0.65)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL20764721	0.84	GRPR (0.70)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30631666	0.84	CTSL (0.62)	CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29638061	0.84	CTSL (0.67)	CTSLCTSSCTSKCTSHC5AR1

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-20240150800-A1	RECOMBINANT ALGAE HAVING HIGH BIOMASS AND LIPID PRODUCTIVITY	PHYKION INC.	2024-05-09	—	—	US	disclosed