SCHEMBL9855053

SCHEMBL9855053

CCOC(=O)C(CC)C(O)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.43
PPARG P37231 3/20 0.43
MAPT P10636 6/20 0.42
KMT2A Q03164 5/20 0.42
LMNA P02545 4/20 0.42
MEN1 O00255 4/20 0.42
CYP1A2 P05177 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 4/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CASP3 P42574 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
ALDH1A1 P00352 3/20 0.37
CES2 O00748 1/20 0.37
ACHE P22303 1/20 0.37
CES1 P23141 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
SCHEMBL9855275 0.83 MAPT (0.43) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL10983101 0.81 CHRM2 (0.43) MAPTKMT2ALMNAMEN1NPSR1
SCHEMBL9855552 0.81 MAPT (0.42) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL9622043 0.80 MAPT (0.41) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL9855217 0.80 MAPT (0.41) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL10977789 0.79 KIF11 (0.46) EPHX2MAPTKMT2ALMNAMEN1
SCHEMBL9855979 0.78 MAPT (0.39) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL29571281 0.75 EPHX2 (0.43) EPHX2PPARGMAPTKMT2ALMNA
SCHEMBL10984423 0.74 L3MBTL1 (0.58) PPARGMAPTKMT2ALMNAMEN1
SCHEMBL8253229 0.74 MAPT (0.44) EPHX2PPARGMAPTKMT2ALMNA

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
US-5011947-A Enzyme inhibitors for cholesterol biosythesis BRISTOL-MYERS (US) 1991-04-30 US disclosed