SCHEMBL12635896

SCHEMBL12635896

COc1ccc(CN2C(=O)NC(=O)C2=O)cc1C(=O)NCc1ccc(Oc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 14/20 0.50
▸ PPARG P37231 7/20 0.50
▸ PPARD Q03181 5/20 0.50
▸ ALDH1A1 P00352 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ TP53 P04637 1/20 0.43
▸ HTT P42858 1/20 0.42

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
SCHEMBL12635630 0.92 PPARA (0.52) PPARAPPARGPPARDALDH1A1SMN1; SMN2
SCHEMBL12634696 0.91 PPARA (0.49) PPARAPPARGPPARDHTT
SCHEMBL12636551 0.91 PPARA (0.52) PPARAPPARGPPARDALDH1A1HTT
SCHEMBL12635895 0.91 PPARA (0.51) PPARAPPARGPPARDALDH1A1HTT
SCHEMBL12635645 0.90 PPARA (0.59) PPARAPPARGPPARDTP53HTT
SCHEMBL12634630 0.89 PPARA (0.59) PPARAPPARGPPARDHTT
SCHEMBL12636561 0.88 PPARA (0.49) PPARAPPARGPPARDNPC1RAB9A
SCHEMBL12636568 0.88 PTGER4 (0.52) PPARAPPARGPPARD
SCHEMBL12634702 0.88 PPARA (0.49) PPARAPPARGPPARDALDH1A1SMN1; SMN2
SCHEMBL12636567 0.88 PPARA (0.48) PPARAPPARGPPARDHTT

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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