SCHEMBL31157717

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(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CTSL	P07711	3/20	0.49

▸	CTSS	P25774	3/20	0.49

▸	CTSK	P43235	3/20	0.49

▸	CTSH	P09668	1/20	0.49

▸	KEAP1	Q14145	1/20	0.43

▸	GLP1R	P43220	4/20	0.42

▸	SCTR	P47872	1/20	0.42

▸	VIPR2	P41587	5/20	0.41

▸	VIPR1	P32241	3/20	0.41

▸	APLNR	P35414	2/20	0.40

▸	BACE1	P56817	1/20	0.40

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	0.93	CTSL (0.46)	CTSLCTSSCTSKCTSHAPLNR
SCHEMBL31157681	0.90	CTSL (0.55)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL31157718	0.90	CTSL (0.48)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL31157665	0.88	BACE1 (0.43)	GLP1RVIPR2VIPR1BACE1
SCHEMBL30775526	0.88	BACE1 (0.43)	GLP1RVIPR2VIPR1BACE1
SCHEMBL31257048	0.88	CTSL (0.45)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL29840375	0.86	GLP1R (0.47)	CTSLCTSSCTSKCTSHKEAP1
SCHEMBL30956347	0.86	GLP1R (0.51)	KEAP1GLP1RSCTRVIPR2VIPR1
SCHEMBL30495616	0.86	GLP1R (0.52)	GLP1RSCTRVIPR2VIPR1
SCHEMBL29387939	0.86	PTPN1 (0.48)	CTSLCTSSCTSKCTSHKEAP1

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