SCHEMBL7111053

SCHEMBL7111053

CCCC(Oc1cccc(C=CCOC(=O)N(c2ccccc2)c2ccccc2)c1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 5/20 0.50
▸ PPARG P37231 4/20 0.50
▸ EPOR P19235 8/20 0.48
▸ MAOB P27338 2/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ ALOX5AP P20292 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ PPARD Q03181 2/20 0.40
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GRIK1 P39086 1/20 0.38
▸ GRIK2 Q13002 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PTGIR P43119 1/20 0.37
▸ PTGDR Q13258 1/20 0.37

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
Tert-Butylamine SCHEMBL7112471 0.87 EPOR (0.46) PPARAPPARGEPORMAOBALOX5
SCHEMBL7111903 0.81 MAOB (0.47) EPORMAOBALOX5ALOX5APPTGS1
SCHEMBL7107402 0.81 MAOB (0.49) EPORMAOBALOX5ALOX5APPTGS1
SCHEMBL7112435 0.81 MAOB (0.51) EPORMAOBALOX5ALOX5APPTGS1
SCHEMBL7105131 0.81 MAOB (0.51) EPORMAOBALOX5ALOX5APPTGS1
SCHEMBL7111050 0.80 MAOB (0.46) EPORMAOBALOX5ALOX5APPTGS1
SCHEMBL7112433 0.78 EPOR (0.46) PPARAPPARGEPORMAOBALOX5
SCHEMBL7105134 0.78 EPOR (0.46) PPARAPPARGEPORMAOBALOX5
SCHEMBL7105126 0.78 EPOR (0.46) PPARAPPARGEPORMAOBALOX5
SCHEMBL7111904 0.78 EPOR (0.46) PPARAPPARGEPORMAOBALOX5

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
EP-1013639-B1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit HOFFMANN LA ROCHE (CH) 2003-10-01 — — EP disclosed
EP-1013639-A1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit F. HOFFMANN-LA ROCHE AG (CH) 2000-06-28 — — EP disclosed
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