SCHEMBL29660238

SCHEMBL29660238

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IL23R Q5VWK5 1/20 0.46
NPY4R P50391 8/20 0.44
NPY5R Q15761 6/20 0.44
NPY1R P25929 5/20 0.44
NPY2R P49146 3/20 0.44
RXFP1 Q9HBX9 1/20 0.42
FOLH1 Q04609 2/20 0.42
TFPI P10646 1/20 0.42
SIRT5 Q9NXA8 1/20 0.41
BACE1 P56817 2/20 0.41
CTSD P07339 1/20 0.41
KISS1R Q969F8 1/20 0.41

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL30168005 0.95 IL23R (0.49) IL23RNPY4RNPY5RNPY1RNPY2R
SCHEMBL30168007 0.95 IL23R (0.49) IL23RNPY4RNPY5RNPY1RNPY2R
SCHEMBL30463248 0.94 FOLH1 (0.46) IL23RFOLH1SIRT5BACE1
SCHEMBL29428964 0.94 FOLH1 (0.46) IL23RFOLH1SIRT5BACE1
SCHEMBL30463274 0.94 FOLH1 (0.46) IL23RFOLH1SIRT5BACE1
SCHEMBL31157664 0.94 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL31157736 0.94 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL31157701 0.92 BACE1 (0.45) IL23RNPY4RNPY5RNPY1RRXFP1
SCHEMBL29660264 0.92 GNPAT (0.45) IL23RFOLH1TFPISIRT5BACE1
SCHEMBL30463272 0.92 FNTA (0.45) IL23RFOLH1SIRT5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4144337-B1 VITIS VINIFERA COSMETIC COMPOSITION GUANGZHOU JIYAN COSMETICS TECH CO LTD (CN) 2024-08-07 EP disclosed
EP-4144337-A1 VITIS VINIFERA COSMETIC COMPOSITION Guangzhou Jiyan Cosmetics Technology Co. Ltd. (CN) 2023-03-08 EP disclosed
CN-108495646-B Compound for treating and/or caring for skin, hair, nails and/or mucous membranes 路博润先进材料公司 2022-07-08 CN disclosed