SCHEMBL23765228

SCHEMBL23765228

CCCC1=N[C@]12CCC(C)=C[C@H]2c1c(O)cc(CCC)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.46
CNR1 P21554 14/20 0.46
TRPV1 Q8NER1 4/20 0.46
TRPM8 Q7Z2W7 4/20 0.46
GPR55 Q9Y2T6 4/20 0.46
OPRM1 P35372 4/20 0.46
TRPA1 O75762 2/20 0.46
TRPV3 Q8NET8 2/20 0.46
TRPV4 Q9HBA0 2/20 0.46
TRPV2 Q9Y5S1 2/20 0.46
CYP1A1 P04798 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2B6 P20813 2/20 0.46
SLC6A2 P23975 2/20 0.46
CYP2C19 P33261 2/20 0.46
SLC6A3 Q01959 2/20 0.46
GPR6 P46095 1/20 0.46
NAAA Q02083 1/20 0.46
DAGLA Q9Y4D2 1/20 0.46
HTR1A P08908 2/20 0.44

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
SCHEMBL23765216 0.83 CNR2 (0.50) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL21756193 0.82 CNR2 (0.51) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL23975514 0.76 CNR2 (0.55) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL24703758 0.76 CNR2 (0.55) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL24703760 0.76 CNR2 (0.55) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL19477707 0.75 CNR2 (0.54) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL14536817 0.72 CNR2 (0.57) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL31545104 0.71 CNR2 (0.51) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL23730516 0.71 CNR2 (0.57) CNR2CNR1TRPV1TRPM8GPR55
SCHEMBL31545846 0.71 CNR2 (0.57) CNR2CNR1TRPV1TRPM8GPR55

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-2021163023-A1 STABLE FORMULATIONS OF DRONABINOL TRYAGx Labs Inc. (US) 2021-08-19 WO disclosed