SCHEMBL11569135

SCHEMBL11569135

CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)CCCc2ccc(Cl)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.64
▸ ABCB11 O95342 1/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ CYP3A4 P08684 1/20 0.64
▸ TSHR P16473 1/20 0.64
▸ HTR2A P28223 1/20 0.64
▸ PMP22 Q01453 1/20 0.64
▸ ALDH1A1 P00352 4/20 0.54
▸ FABP2 P12104 1/20 0.54
▸ PPARG P37231 1/20 0.54
▸ PPARD Q03181 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ POLB P06746 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ OPRK1 P41145 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC4 P56524 1/20 0.47

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
SCHEMBL11569976 0.94 PPARA (0.67) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11568562 0.89 PPARA (0.67) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11571616 0.87 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11571471 0.87 PPARA (0.70) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11571923 0.87 PPARA (0.71) PPARACYP1A2CYP3A4ALDH1A1FABP2
SCHEMBL11769439 0.85 STS (0.54) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11569011 0.84 PPARA (0.65) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11570049 0.83 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11570531 0.83 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11709945 0.82 PPARA (0.71) PPARAABCB11CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4151303-A Phenoxyalkylcarboxylic acid compounds and serum-lipid and triglyceride depressing therapeutic compositions BOEHRINGER MANNHEIM GMBH (DE) 1979-04-24 — — US disclosed
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