SCHEMBL11774532

SCHEMBL11774532

CCCCCCCCCCCCCCCCCCc1cc(OC(=O)c2ccccc2)c2c(c1)OC(CC)(CC)C1=C2CCC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 9/20 0.42
▸ CNR1 P21554 6/20 0.42
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ BCHE P06276 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ SPHK2 Q9NRA0 1/20 0.33
▸ SPHK1 Q9NYA1 1/20 0.33
▸ PRKCA P17252 1/20 0.33

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
SCHEMBL11775042 0.85 CNR2 (0.40) CNR2CNR1PPARGPPARABCHE
SCHEMBL11810292 0.78 CNR2 (0.40) CNR2CNR1
SCHEMBL11780197 0.78 CNR2 (0.59) CNR2CNR1
SCHEMBL11852247 0.73 CNR2 (0.53) CNR2CNR1
SCHEMBL11776964 0.70 CNR2 (0.46) CNR2CNR1
SCHEMBL11740174 0.69 CNR2 (0.53) CNR2CNR1PPARG
SCHEMBL11811066 0.68 CNR2 (0.48) CNR2CNR1
SCHEMBL11814326 0.67 CNR2 (0.47) CNR2CNR1
SCHEMBL27548860 0.67 RARB (0.51) CNR2PPARGPPARABCHEMEN1
SCHEMBL25258530 0.67 CNR2 (0.66) CNR2CNR1

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
US-4051152-A TRANQUILIZERS, ANALGESICS SHARPS ASSOCIATES (US) 1977-09-27 — — US disclosed
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