SCHEMBL23765216

SCHEMBL23765216

CCCCc1cc(O)c([C@@H]2C=C(C)CC[C@]23N=C3C)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.50
OPRM1 P35372 5/20 0.50
CNR1 P21554 13/20 0.47
TRPV1 Q8NER1 4/20 0.46
TRPM8 Q7Z2W7 4/20 0.46
GPR55 Q9Y2T6 4/20 0.46
ACE2 Q9BYF1 2/20 0.46
NR1I2 O75469 2/20 0.46
LDHA P00338 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
HTR1A P08908 2/20 0.46
MLNR O43193 1/20 0.46
PDE9A O76083 1/20 0.46
ABCB11 O95342 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL21756193 0.96 CNR2 (0.51) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL23765228 0.83 CNR2 (0.46) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL14536817 0.80 CNR2 (0.57) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL23765225 0.80 DAGLA (0.54) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL23765308 0.79 BCHE (0.39) CNR2OPRM1CNR1ACE2
SCHEMBL31545104 0.79 CNR2 (0.51) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL24703848 0.79 CNR2 (0.57) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL24703849 0.79 CNR2 (0.57) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL22957095 0.76 ACE2 (0.53) CNR2OPRM1CNR1TRPV1TRPM8
SCHEMBL23052897 0.75 CNR2 (0.57) CNR2OPRM1CNR1TRPV1TRPM8

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