SCHEMBL7559299

SCHEMBL7559299

CCc1ccc(O)c(OC)c1CC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.41
CA1 P00915 2/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
CA2 P00918 1/20 0.39
DRD2 P14416 1/20 0.39
POLB P06746 1/20 0.38
PPARG P37231 1/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
ALOX5 P09917 1/20 0.36
MAOA P21397 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
BACE1 P56817 1/20 0.34

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
SCHEMBL30290818 0.90 TRPV1 (0.40) TRPV1CA1CA12CA7CA9
SCHEMBL11231888 0.89 TRPV1 (0.37) TRPV1CA1CA12CA7CA9
SCHEMBL2820470 0.87 HMGCR (0.44) TRPV1POLBALOX5GABRA1GABRB2
SCHEMBL12504376 0.83 TRPV1 (0.43) TRPV1CA1CA12CA7CA9
SCHEMBL15427430 0.83 PTGS2 (0.37) DRD2GABRA1GABRB2
SCHEMBL1173287 0.83 ALOX5 (0.44) POLBALOX5GABRA1GABRB2
SCHEMBL29385020 0.82 ESR1 (0.39) ESR1ESR2GABRA1GABRB2BACE1
SCHEMBL29719141 0.82 GABRA1 (0.46) TRPV1CA1CA12CA7CA9
SCHEMBL19463402 0.80 TRPV1 (0.41) TRPV1CA1CA12CA7CA9
SCHEMBL16200913 0.80 ALOX5 (0.39) CA1CA12CA7CA9CA13

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
WO-2002013779-A1 SKIN LIGHTENING AGENTS ZYLEPSIS LIMITED (GB) 2002-02-21 WO disclosed