SCHEMBL9255523

SCHEMBL9255523

CCOC(=O)C1COc2cc(C(C)=O)ccc2O1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ATM Q13315 1/20 0.46
POLB P06746 3/20 0.44
ALDH1A1 P00352 2/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL7203233 0.95 CYP4F2 (0.47) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL23420316 0.90 ALDH1A1 (0.48) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL1519333 0.85 CYP4F2 (0.50) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL23420330 0.83 USP2 (0.53) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL9254561 0.83 CYP4F2 (0.46) CYP4F2CYP4A11ATMPOLBALDH1A1
SCHEMBL1519281 0.83 POLB (0.58) CYP4F2CYP4A11KDM4EPOLBALDH1A1
SCHEMBL1519467 0.83 CYP4F2 (0.48) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL9255724 0.83 CYP4F2 (0.54) CYP4F2CYP4A11KDM4EATMPOLB
SCHEMBL7483813 0.82 CYP4F2 (0.51) CYP4F2CYP4A11POLBALDH1A1RECQL
SCHEMBL7483826 0.82 CYP4F2 (0.51) CYP4F2CYP4A11POLBALDH1A1RECQL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed