SCHEMBL11458283

SCHEMBL11458283

CC(C)(Oc1ccc(Cc2ccc(Cl)cc2)cc1)C(=O)Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 12/20 0.60
▸ CYP1A2 P05177 3/20 0.60
▸ CYP3A4 P08684 3/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ MAPT P10636 2/20 0.60
▸ CYP2C19 P33261 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ OPRK1 P41145 1/20 0.58
▸ ABCB11 O95342 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ HTR2A P28223 2/20 0.56
▸ PMP22 Q01453 2/20 0.56
▸ PPARG P37231 6/20 0.53
▸ FABP2 P12104 2/20 0.53
▸ SLC22A12 Q96S37 1/20 0.53
▸ PPARD Q03181 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ CNR1 P21554 4/20 0.49

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
SCHEMBL135713 0.90 PPARA (0.72) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL3811479 0.87 PPARA (0.81) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11471320 0.86 PPARA (0.58) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11537290 0.85 PPARA (0.66) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11478612 0.83 OPRK1 (0.73) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL822492 0.82 PPARA (0.77) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11074943 0.82 PPARA (0.86) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11639698 0.81 OPRK1 (0.62) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL31742332 0.81 CNR1 (0.73) PPARACYP1A2CYP3A4MEN1MAPT
SCHEMBL11539959 0.81 PPARA (0.60) PPARACYP1A2CYP3A4MEN1MAPT

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-4182902-A P-(P'-CHLOROBENZYL) PHENOXYACETIC ACID SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-01-08 — — US disclosed
US-4153803-A Cholesterol-lowering phenoxyalkanoic acid esters SIEGFRIED AKTIENGESELLSCHAFT (CH) 1979-05-08 — — US disclosed
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