SCHEMBL11564292

SCHEMBL11564292

CCC(Oc1ccc(Cl)cc1)(C(=O)OC)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ PMP22 Q01453 1/20 0.47
▸ OPRK1 P41145 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ MMP1 P03956 3/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MAPK14 Q16539 1/20 0.39
▸ PPARG P37231 3/20 0.38
▸ FABP2 P12104 2/20 0.38
▸ SLC22A12 Q96S37 1/20 0.38

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
SCHEMBL11558868 0.85 MAPK14 (0.40) PPARAMEN1MAPTKMT2AALDH1A1
SCHEMBL11566652 0.78 PPARA (0.49) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL21991231 0.76 PPARA (0.62) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL21103836 0.75 PPARA (0.53) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL19183361 0.75 OPRK1 (0.66) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL21129124 0.74 PPARA (0.51) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL11596750 0.72 PSEN1 (0.41) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL21119415 0.71 L3MBTL1 (0.47) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL2121452 0.71 PPARA (0.68) PPARACYP3A4CYP1A2ABCB11TSHR
SCHEMBL28541524 0.70 KCNN4 (0.43) CYP1A2TSHRCYP2D6MAPTCYP2C19

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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