SCHEMBL8067805

SCHEMBL8067805

CCCCCC[C@@H](O)C/C=C\CCCCCCC(C)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.55
▸ FFAR4 Q5NUL3 1/20 0.55
▸ FAAH O00519 5/20 0.50
▸ NFKB1 P19838 1/20 0.47
▸ NFKB2 Q00653 1/20 0.47
▸ RELA Q04206 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.46
▸ EPHX2 P34913 2/20 0.44
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42

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
SCHEMBL7496265 0.87 FFAR1 (0.61) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL27749375 0.85 CETP (0.52) CNR2
SCHEMBL5809070 0.85 CETP (0.52) CNR2
SCHEMBL30111762 0.85 CETP (0.52) CNR2
SCHEMBL28521012 0.85 CETP (0.52) CNR2
SCHEMBL10949172 0.85 CETP (0.52) CNR2
SCHEMBL29198459 0.85 CETP (0.52) CNR2
SCHEMBL27908539 0.85 CETP (0.52) CNR2
Hydrochloric Acid SCHEMBL30749387 0.83 CETP (0.51) CNR2
SCHEMBL8061902 0.83 ALDH1A1 (0.52) CNR2

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
JP-2000008092-A CLEANING AGENT FOR MOLD FOR POLYESTER RESIN AND CLEANING METHOD USING THE SAME TOYOBO CO LTD 2000-01-11 — — JP disclosed
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