SCHEMBL21963798

SCHEMBL21963798

CC1=CC(O)[C@H](C(C)(C)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
CHRNA7 P36544 1/20 0.34
STAT3 P40763 1/20 0.34
GBA1 P04062 1/20 0.31
HIF1A Q16665 3/20 0.31
CES2 O00748 2/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
EPAS1 Q99814 1/20 0.31
GPR55 Q9Y2T6 1/20 0.30

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
SCHEMBL21903093 1.00 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL4859375 1.00 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL4862343 1.00 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
Alcohol SCHEMBL4865871 0.93 LMNA (0.41) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL11457314 0.89 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL11457315 0.89 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
Fumaric Acid SCHEMBL10486731 0.87 LMNA (0.37) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL1617981 0.79 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL12746227 0.79 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL12716850 0.79 LMNA (0.46) LMNAMEN1CYP3A4ALOX15MAPK1

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-2020099942-A1 PROCESS AND COMPOUNDS FOR PREPARATION OF CANNABINOIDS EMBIO LIMITED (IN) 2020-05-22 WO disclosed