SCHEMBL9617849

SCHEMBL9617849

CCCCCCCCCCCCCCCC(=O)OCc1cc(OC)c(CC=C(C)CC(=O)C=C(C)C)c(O)c1C=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.44
▸ PPARD Q03181 3/20 0.44
▸ PPARA Q07869 3/20 0.44
▸ TRPV1 Q8NER1 11/20 0.38
▸ DNMT1 P26358 1/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.36
▸ TOP2A P11388 1/20 0.35
▸ IMPDH2 P12268 1/20 0.35

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
SCHEMBL9617870 0.69 PRKCA (0.33) TRPV1TOP2A
SCHEMBL10401104 0.61 ALDH1A1 (0.53) TRPV1TOP2A
SCHEMBL10400932 0.61 ALDH1A1 (0.53) TRPV1TOP2A
SCHEMBL8703328 0.61 ERN1 (0.49) TRPV1
SCHEMBL10717346 0.61 ERN1 (0.49) TRPV1
Vanillyl Decanoate SCHEMBL2208020 0.60 TRPV1 (0.69) TRPV1
SCHEMBL3118280 0.60 TRPV1 (0.69) TRPV1
SCHEMBL19126075 0.60 TRPV1 (0.69) TRPV1
SCHEMBL3114562 0.60 TRPV1 (0.69) TRPV1
Vanillyl Laurate SCHEMBL3124815 0.60 TRPV1 (0.69) TRPV1

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
JP-4266848-A — — None — — JP disclosed
JP-H04266848-A BENZYL ALCOHOL DERIVATIVE AND PGE2 PRODUCTION SUPPRESSING AGENT AND NGF PRODUCTION INDUCING AGENT CONTAINING THE DERIVATIVE AS ACTIVE COMPONENT KAGOME CO LTD 1992-09-22 — — JP disclosed
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