SCHEMBL11566652

SCHEMBL11566652

COC(=O)C(C)(Oc1ccc(Cl)cc1)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 8/20 0.49
▸ CYP1A2 P05177 4/20 0.49
▸ CYP3A4 P08684 4/20 0.49
▸ CYP2C19 P33261 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ABCB11 O95342 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ HTR2A P28223 2/20 0.47
▸ PMP22 Q01453 2/20 0.47
▸ PPARG P37231 4/20 0.43
▸ FABP2 P12104 2/20 0.43
▸ SLC22A12 Q96S37 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ PPARD Q03181 1/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ USP2 O75604 1/20 0.42

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
SCHEMBL11563901 0.87 PPARA (0.45) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11565501 0.87 MCL1 (0.40) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11562523 0.85 PPARA (0.43) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11568731 0.84 PPARA (0.60) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL21991231 0.83 PPARA (0.62) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11597273 0.83 KMT2A (0.46) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL5389836 0.81 PPARG (0.50) PPARAMEN1MAPTKMT2APPARG
SCHEMBL11600781 0.79 PPARA (0.57) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11565233 0.78 PPARA (0.53) PPARACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL11564292 0.78 PPARA (0.47) PPARACYP1A2CYP3A4CYP2C19MEN1

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-4168385-A LOWERING OF STEROL AND TRIGLYCERIDE SERUM LEVELS AMERICAN CYANAMID COMPANY (US) 1979-09-18 — — US disclosed
US-4125729-A Hypolipemic α-aryloxy para substituted phenyl acetic acid compounds AMERICAN CYANAMID COMPANY (US) 1978-11-14 — — US disclosed
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