SCHEMBL30988898

C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O

nearest known ligand 0.56

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	CTSL	P07711	3/20	0.56

▸	CTSS	P25774	3/20	0.56

▸	CTSK	P43235	3/20	0.56

▸	CTSH	P09668	1/20	0.56

▸	IL23R	Q5VWK5	2/20	0.54

▸	CXCR4	P61073	3/20	0.54

▸	KISS1R	Q969F8	5/20	0.54

▸	NPY1R	P25929	1/20	0.51

▸	NPY2R	P49146	1/20	0.51

▸	NPY4R	P50391	1/20	0.51

▸	NPY5R	Q15761	1/20	0.51

▸	CAPN1	P07384	2/20	0.50

▸	CTSB	P07858	2/20	0.50

▸	CTNNB1	P35222	1/20	0.49

▸	RAMP3	O60896	3/20	0.49

▸	CALCR	P30988	3/20	0.49

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
SCHEMBL30565410	0.88	C5AR1 (0.56)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL16566036	0.87	CXCR4 (0.57)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL8937035	0.86	CXCR4 (0.56)	CTSLCTSSCTSKCTSHCXCR4
SCHEMBL29463744	0.86	KISS1R (0.60)	IL23RCXCR4KISS1RCAPN1CTSB
SCHEMBL29463731	0.86	CXCR4 (0.58)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL13319650	0.86	IL23R (0.63)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL31468796	0.86	KISS1R (0.64)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL31073511	0.86	CXCR4 (0.61)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL30780077	0.86	CTSL (0.55)	CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31433347	0.85	KISS1R (0.56)	IL23RCXCR4KISS1RCAPN1CTSB

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-2024097353-A1	RECOMBINANT ALGAE HAVING HIGH BIOMASS AND LIPID PRODUCTIVITY	VIRIDOS, INC. (US)	2024-05-10	—	—	WO	disclosed