SCHEMBL23765190

SCHEMBL23765190

CCCCc1cc2c(c(O)c1C(=O)O)C(C(C)(C)CC)CC(C)O2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAGLA Q9Y4D2 4/20 0.42
▸ CNR1 P21554 2/20 0.42
▸ CNR2 P34972 2/20 0.42
▸ PPARG P37231 2/20 0.42
▸ LDHA P00338 1/20 0.42
▸ TRPM8 Q7Z2W7 1/20 0.42
▸ NAAA Q02083 1/20 0.38
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ MAOA P21397 1/20 0.35
▸ SMPD1 P17405 1/20 0.35
▸ PPARD Q03181 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.32
▸ TRPM7 Q96QT4 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ TOP2A P11388 1/20 0.32

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
SCHEMBL23765132 0.97 DAGLA (0.46) DAGLACNR1CNR2PPARGLDHA
SCHEMBL23765219 0.94 DAGLA (0.39) DAGLACNR1CNR2PPARGLDHA
SCHEMBL23765197 0.73 CNR2 (0.44) CNR1CNR2LDHATRPM8OPRM1
SCHEMBL24301065 0.67 DAGLA (0.41) DAGLACNR1CNR2PPARGLDHA
SCHEMBL19591977 0.67 CNR2 (0.51) DAGLACNR1CNR2PPARGLDHA
SCHEMBL25878233 0.67 CNR1 (0.68) DAGLACNR1CNR2PPARGLDHA
SCHEMBL25877929 0.67 CNR1 (0.68) DAGLACNR1CNR2PPARGLDHA
SCHEMBL25878237 0.67 CNR1 (0.68) DAGLACNR1CNR2PPARGLDHA
SCHEMBL20906089 0.66 DAGLA (0.43) DAGLACNR1CNR2PPARGLDHA
SCHEMBL20764364 0.66 DAGLA (0.48) DAGLACNR1CNR2PPARGLDHA

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
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