SCHEMBL4738414

SCHEMBL4738414

COC1CC[C@]2(C)C3=C(CCC2C1(C)C)[C@]1(C)CC[C@H]([C@H](C)CCC=C(C)C)[C@@]1(C)CC3

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.82
USP2 O75604 2/20 0.82
ALDH1A1 P00352 2/20 0.82
CYP3A4 P08684 2/20 0.82
ALOX15 P16050 2/20 0.82
CRYAB P02511 2/20 0.79
LMNA P02545 1/20 0.79
PTGES O14684 4/20 0.71
FNTA P49354 1/20 0.69
FNTB P49356 1/20 0.69
PREP P48147 1/20 0.59
PIN1 Q13526 1/20 0.59
MEN1 O00255 1/20 0.58
PLA2G1B P04054 1/20 0.58
DNMT1 P26358 1/20 0.58
BLM P54132 1/20 0.58
KMT2A Q03164 1/20 0.58
ATG4B Q9Y4P1 1/20 0.58
CRYAA P02489 1/20 0.56

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
SCHEMBL4737573 0.92 MAPT (0.80) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL30218047 0.91 MAPT (0.77) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL4738563 0.91 MAPT (0.79) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL19194140 0.90 MAPT (1.00) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL4736924 0.90 MAPT (0.78) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL415760 0.90 MAPT (1.00) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL5666302 0.90 MAPT (1.00) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL4735778 0.90 MAPT (0.78) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL2340127 0.90 MAPT (1.00) MAPTUSP2ALDH1A1CYP3A4ALOX15
SCHEMBL17431708 0.90 MAPT (1.00) MAPTUSP2ALDH1A1CYP3A4ALOX15

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-2008077247-A1 COATINGS FOR IMPLANTABLE MEDICAL DEVICES COMPRISING CHOLESTEROL MIV THERAPEUTICS INC. (CA) 2008-07-03 WO disclosed