SCHEMBL30112151

SCHEMBL30112151

CC(CCC(=O)O)c1ccc(O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.47
SRC P12931 1/20 0.41
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
HSP90AB1 P08238 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL21903498 1.00 TYR (0.47) TYRSRCCA12CA1CA2
SCHEMBL4420962 0.90 TYR (0.45) TYRSRCCA12CA1CA2
SCHEMBL20576228 0.85 MEN1 (0.43) TYRSRCCA12CA1CA2
SCHEMBL30112103 0.85 MEN1 (0.43) TYRSRCCA12CA1CA2
SCHEMBL29712429 0.84 TYR (0.40) TYRSRCALDH1A1
SCHEMBL20576405 0.84 TYR (0.40) TYRSRCALDH1A1
SCHEMBL20576229 0.83 TYR (0.39) TYRSRC
SCHEMBL29712411 0.83 TYR (0.39) TYRSRC
SCHEMBL3239754 0.83 TYR (0.50) TYRCA12CA1CA2CA7
SCHEMBL71452 0.82 TYR (0.49) TYRSRCTSHR

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110678454-B Resorcinol derivatives for their cosmetic use 莱雅公司 2022-12-06 CN disclosed