SCHEMBL31157701

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

nearest known ligand 0.45

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	4/20	0.45

▸	BACE2	Q9Y5Z0	1/20	0.42

▸	SIRT5	Q9NXA8	1/20	0.42

▸	FOLH1	Q04609	1/20	0.42

▸	RXFP1	Q9HBX9	2/20	0.41

▸	GNPAT	O15228	1/20	0.41

▸	NPY5R	Q15761	3/20	0.40

▸	NPY1R	P25929	2/20	0.40

▸	NPY4R	P50391	2/20	0.40

▸	FNTA	P49354	2/20	0.40

▸	FNTB	P49356	2/20	0.40

▸	PGGT1B	P53609	1/20	0.40

▸	IL23R	Q5VWK5	1/20	0.40

▸	TFPI	P10646	1/20	0.40

▸	CTSL	P07711	1/20	0.39

▸	CTSH	P09668	1/20	0.39

▸	CTSS	P25774	1/20	0.39

▸	CTSK	P43235	1/20	0.39

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
SCHEMBL29897725	0.96	BACE1 (0.45)	BACE1BACE2SIRT5RXFP1GNPAT
SCHEMBL31157666	0.96	BACE1 (0.45)	BACE1BACE2SIRT5RXFP1GNPAT
SCHEMBL30463274	0.95	FOLH1 (0.46)	BACE1SIRT5FOLH1GNPATFNTA
SCHEMBL30463248	0.95	FOLH1 (0.46)	BACE1SIRT5FOLH1GNPATFNTA
SCHEMBL29428964	0.95	FOLH1 (0.46)	BACE1SIRT5FOLH1GNPATFNTA
SCHEMBL31157630	0.94	SIRT5 (0.48)	BACE1BACE2SIRT5RXFP1NPY5R
SCHEMBL31157658	0.94	SIRT5 (0.48)	BACE1BACE2SIRT5RXFP1NPY5R
SCHEMBL31157768	0.93	BACE1 (0.46)	BACE1BACE2SIRT5FOLH1RXFP1
SCHEMBL30463254	0.93	RXFP1 (0.43)	BACE1BACE2SIRT5RXFP1NPY5R
SCHEMBL30463263	0.93	RXFP1 (0.43)	BACE1BACE2SIRT5RXFP1NPY5R

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