SCHEMBL23765188

SCHEMBL23765188

CCCc1cc(O)c([C@@H]2C=C(C)CC[C@]23N=C3C)c(O)c1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 3/20 0.56
NAAA Q02083 1/20 0.48
CNR1 P21554 14/20 0.42
CNR2 P34972 10/20 0.42
LDHA P00338 1/20 0.42
PPARG P37231 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
PTPN1 P18031 3/20 0.39
PTPN11 Q06124 2/20 0.39
HTR1A P08908 1/20 0.35
PTPN2 P17706 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
SCHEMBL23765225 0.94 DAGLA (0.54) DAGLANAAACNR1CNR2LDHA
SCHEMBL24703764 0.82 DAGLA (0.62) DAGLANAAACNR1CNR2LDHA
SCHEMBL24703761 0.82 DAGLA (0.62) DAGLANAAACNR1CNR2LDHA
SCHEMBL24704101 0.76 DAGLA (0.57) DAGLANAAACNR1CNR2LDHA
SCHEMBL24704102 0.75 DAGLA (0.64) DAGLANAAACNR1CNR2LDHA
SCHEMBL22564594 0.75 DAGLA (0.64) DAGLANAAACNR1CNR2LDHA
SCHEMBL24132001 0.75 DAGLA (0.64) DAGLANAAACNR1CNR2LDHA
SCHEMBL23158569 0.75 DAGLA (0.64) DAGLANAAACNR1CNR2LDHA
SCHEMBL23765189 0.75 DAGLA (0.64) DAGLANAAACNR1CNR2LDHA
SCHEMBL23765216 0.74 CNR2 (0.50) DAGLANAAACNR1CNR2LDHA

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