SCHEMBL4878774

SCHEMBL4878774

C/C=C\CC/C=C/C=C/C(=O)NCC(C)(C)O

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.85
CNR1 P21554 11/20 0.85
TRPA1 O75762 1/20 0.75
TRPV1 Q8NER1 1/20 0.75
PPARG P37231 4/20 0.60
PPARD Q03181 4/20 0.60
PPARA Q07869 4/20 0.60
FAAH O00519 1/20 0.38

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
SCHEMBL4878782 1.00 CNR2 (0.85) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL4885154 1.00 CNR2 (0.85) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL29822405 0.98 CNR2 (0.83) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL26127030 0.94 CNR2 (0.97) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL1030994 0.92 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL1030779 0.92 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL28661229 0.92 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL30698242 0.86 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL1031361 0.86 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG
SCHEMBL30698241 0.86 CNR2 (1.00) CNR2CNR1TRPA1TRPV1PPARG

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-20080038386-A1 Use of a liquid cooling sensate to provide a pungent, warming or tingling sensate composition MOZA ASHOK K 2008-02-14 US disclosed