SCHEMBL30541579

SCHEMBL30541579

CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.41
▸ NPY1R P25929 7/20 0.41
▸ NPY2R P49146 6/20 0.41
▸ NPY5R Q15761 6/20 0.41
▸ CPB2 Q96IY4 1/20 0.41
▸ NMT2 O60551 1/20 0.40
▸ NMT1 P30419 1/20 0.40
▸ SLC6A5 Q9Y345 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.39
▸ TLR2 O60603 1/20 0.38
▸ SIRT6 Q8N6T7 1/20 0.38
▸ SIRT1 Q96EB6 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29619336 0.92 CPB2 (0.45) NPY4RNPY1RNPY2RNPY5RCPB2
SCHEMBL29678580 0.92 TERT (0.42) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30463291 0.88 CPB2 (0.42) NPY4RNPY1RNPY2RNPY5RCPB2
SCHEMBL29402150 0.88 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RRXFP1
SCHEMBL30962454 0.88 NPY4R (0.39) NPY4RNPY1RNPY2RNPY5RRXFP1
SCHEMBL30111320 0.87 NPY4R (0.43) NPY4RNPY1RNPY2RNPY5R
SCHEMBL607985 0.86 NOD1 (0.40) NPY4RNPY1RNPY2RNPY5RRXFP1
SCHEMBL607984 0.86 NOD1 (0.40) NPY4RNPY1RNPY2RNPY5RRXFP1
SCHEMBL30563214 0.86 NOD1 (0.40) NPY4RNPY1RNPY2RNPY5RRXFP1
SCHEMBL8010129 0.86 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RNMT2

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
CN-117481998-A Retinol substitutes in skin treatment 西姆莱斯有限公司 2024-02-02 — — CN disclosed
CN-110149795-B cosmetic mixture 西姆莱斯股份公司 2023-10-03 — — CN disclosed
CN-116528824-A Composition comprising an ultraviolet filter and one or more (bio) -alkanediols 西姆莱斯股份公司 2023-08-01 — — CN disclosed
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