SCHEMBL23946245

SCHEMBL23946245

CCCCCc1cc(O)c(C2C=C(C)CCC2)c(OC(C)C)c1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 3/20 0.52
NAAA Q02083 1/20 0.52
CNR1 P21554 10/20 0.47
CNR2 P34972 7/20 0.45
LDHA P00338 1/20 0.43
PPARG P37231 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
OPRM1 P35372 2/20 0.40
ACE2 Q9BYF1 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGES O14684 1/20 0.37
TOP2A P11388 1/20 0.37
PTPN1 P18031 1/20 0.37

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
SCHEMBL20047254 0.86 DAGLA (0.52) DAGLANAAACNR1CNR2LDHA
SCHEMBL23026535 0.86 DAGLA (0.52) DAGLANAAACNR1CNR2LDHA
SCHEMBL29552874 0.85 DAGLA (0.66) DAGLANAAACNR1CNR2LDHA
SCHEMBL20987927 0.85 DAGLA (0.66) DAGLANAAACNR1CNR2LDHA
SCHEMBL20047222 0.85 DAGLA (0.57) DAGLANAAACNR1CNR2LDHA
SCHEMBL22860828 0.85 DAGLA (0.66) DAGLANAAACNR1CNR2LDHA
SCHEMBL23765238 0.83 DAGLA (0.48) DAGLANAAACNR1CNR2LDHA
SCHEMBL23155099 0.82 DAGLA (0.61) DAGLANAAACNR1CNR2LDHA
SCHEMBL23166670 0.81 CNR1 (0.55) DAGLANAAACNR1CNR2LDHA
SCHEMBL29730325 0.81 CNR1 (0.55) 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-2021211611-A1 CANNABINOID SYNTHASE VARIANTS AND METHODS FOR THEIR USE GENOMATICA, INC. (US) 2021-10-21 WO disclosed