SCHEMBL31157718

CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CTSL	P07711	3/20	0.48

▸	CTSS	P25774	3/20	0.48

▸	CTSK	P43235	3/20	0.48

▸	CTSH	P09668	1/20	0.48

▸	NPY4R	P50391	11/20	0.43

▸	NPY1R	P25929	6/20	0.43

▸	NPY2R	P49146	5/20	0.43

▸	NPY5R	Q15761	5/20	0.43

▸	PTH1R	Q03431	1/20	0.39

▸	KEAP1	Q14145	1/20	0.39

▸	APLNR	P35414	2/20	0.39

▸	IL23R	Q5VWK5	1/20	0.38

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
SCHEMBL31157744	0.95	CTSL (0.46)	CTSLCTSSCTSKCTSHNPY4R
SCHEMBL31157683	0.93	CTSL (0.51)	CTSLCTSSCTSKCTSHNPY4R
SCHEMBL31157717	0.90	CTSL (0.49)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL29655801	0.87	CTSL (0.44)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL31157681	0.86	CTSL (0.55)	CTSLCTSSCTSKCTSHNPY4R
SCHEMBL29591913	0.86	NPY4R (0.52)	CTSLCTSSCTSKCTSHNPY4R
SCHEMBL20827629	0.85	NPY4R (0.45)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL31279096	0.85	NPY4R (0.45)	NPY4RNPY1RNPY2RNPY5RIL23R
SCHEMBL29655666	0.84	CTSL (0.46)	CTSLCTSSCTSKCTSHPTH1R
SCHEMBL30952096	0.84	NPY4R (0.43)	NPY4RNPY1RNPY2RNPY5RAPLNR

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
EP-3548510-B1	COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES	LUBRIZOL ADVANCED MAT INC (US)	2024-10-02	—	—	EP	disclosed