SCHEMBL30168005

SCHEMBL30168005

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IL23R Q5VWK5 2/20 0.49
SIRT5 Q9NXA8 2/20 0.48
NPY4R P50391 12/20 0.47
NPY5R Q15761 8/20 0.47
NPY1R P25929 8/20 0.47
NPY2R P49146 5/20 0.47
RXFP1 Q9HBX9 1/20 0.46
KISS1R Q969F8 1/20 0.44
TFPI P10646 1/20 0.44

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
SCHEMBL30168007 1.00 IL23R (0.49) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30167998 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30052015 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30463260 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30998021 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL31157760 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30168008 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL12066140 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL31157647 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R
SCHEMBL30173825 0.94 SIRT5 (0.53) IL23RSIRT5NPY4RNPY5RNPY1R

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 2 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