SCHEMBL11643674

SCHEMBL11643674

CC(C)(Oc1ccc(Cl)cc1)C(=O)OC(=O)C(C)(C)Oc1ccc(Cl)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.70
CYP1A2 P05177 5/20 0.70
CYP3A4 P08684 5/20 0.70
CYP2C19 P33261 4/20 0.70
MAPT P10636 4/20 0.70
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
CYP2D6 P10635 2/20 0.70
ABCB11 O95342 2/20 0.70
TSHR P16473 2/20 0.70
HTR2A P28223 2/20 0.70
PMP22 Q01453 2/20 0.70
PPARG P37231 3/20 0.60
CYP2C9 P11712 3/20 0.60
USP2 O75604 2/20 0.60
LMNA P02545 2/20 0.60
MAPK1 P28482 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
TDP1 Q9NUW8 2/20 0.60

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
SCHEMBL11643680 0.88 PPARA (0.69) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL2121452 0.87 PPARA (0.68) PPARACYP1A2CYP3A4CYP2C19MAPT
Dulofibrate SCHEMBL2110601 0.87 PPARA (0.68) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL23903398 0.85 PPARA (0.66) PPARACYP1A2CYP3A4CYP2C19MAPT
Clofibric Acid SCHEMBL102826 0.82 PPARA (1.00) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL10867374 0.82 PPARA (0.72) PPARACYP1A2CYP3A4CYP2C19MAPT
Clofibric Acid SCHEMBL2227936 0.82 PPARA (1.00) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL9372364 0.82 PPARA (0.72) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL135713 0.82 PPARA (0.72) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL21992457 0.82 CNR1 (0.86) PPARACYP1A2CYP3A4CYP2C19MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4118583-A ANTICOAGULANT, ANTICHOLINERGIC AGENTS LABORATORIES OM SOCIETE ANONYME (CH) 1978-10-03 US disclosed
US-4115648-A HYPOCHOLESTEROLEMIC, HYPOTRIGLYCIDEMIC, HYPOLIPIDEMIC LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1978-09-19 US disclosed
US-4031240-A HYPOCHOLESTEROLEMIC, HYPOTRIGLYCIDEMIC, HYPOLIPIDEMIC LABORATORIOS DEL DR. ESTEVE S.A. (ES) 1977-06-21 US disclosed
US-3954767-A HYPOCHOLESTEROLEMIC, HYPOTRIGLYCIDEMIC AND HYPOLIPIDEMIC ACTIVITY PROVESAN SA, 19, RUE DE LA CROIX D'OR, GENEVA, SWITZERLAND, A SWISS CORP. 1976-05-04 US disclosed