SCHEMBL12636561

SCHEMBL12636561

COC(=O)c1ccc(Oc2ccc(CNC(=O)c3cc(CN4C(=O)NC(=O)C4=O)ccc3OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 7/20 0.49
▸ PPARD Q03181 4/20 0.49
▸ PPARG P37231 4/20 0.49
▸ LMNA P02545 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ PTGER4 P35408 1/20 0.43
▸ PTGER2 P43116 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL12636568 0.93 PTGER4 (0.52) PPARAPPARDPPARGPTGER4PTGER2
SCHEMBL12635630 0.93 PPARA (0.52) PPARAPPARDPPARGHTTKDM4E
SCHEMBL12636567 0.92 PPARA (0.48) PPARAPPARDPPARGPTGER4PTGER2
SCHEMBL12635895 0.92 PPARA (0.51) PPARAPPARDPPARGHPGDHTT
SCHEMBL12635645 0.91 PPARA (0.59) PPARAPPARDPPARGHPGDHTT
SCHEMBL12636551 0.90 PPARA (0.52) PPARAPPARDPPARGLMNAHPGD
SCHEMBL12634696 0.90 PPARA (0.49) PPARAPPARDPPARGHTT
SCHEMBL12634630 0.90 PPARA (0.59) PPARAPPARDPPARGPTGER4PTGER2
SCHEMBL12634702 0.89 PPARA (0.49) PPARAPPARDPPARGHTT
SCHEMBL12635896 0.88 PPARA (0.50) PPARAPPARDPPARGHTTNPC1

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
WO-2011078370-A1 NOVEL PARABANIC ACID DERIVATIVE AND DRUG HAVING THE SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2011-06-30 — — WO disclosed
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