SCHEMBL26430083

SCHEMBL26430083

C=CC/C=C\C/C=C\CCCCCCCc1cccc(OC(=O)CCCCCCC/C=C\CCCCCCCC)c1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.60
▸ PPARG P37231 3/20 0.57
▸ EPHX2 P34913 5/20 0.54
▸ FAAH O00519 3/20 0.54
▸ PTGIR P43119 1/20 0.48
▸ CNR1 P21554 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
SCHEMBL26430081 1.00 PPARA (0.60) PPARAPPARGEPHX2FAAHPTGIR
SCHEMBL28392302 0.85 PPARA (0.63) PPARAPPARGEPHX2CNR1
SCHEMBL29328702 0.85 PPARA (0.63) PPARAPPARGEPHX2CNR1
SCHEMBL29328706 0.85 PPARA (0.63) PPARAPPARGEPHX2CNR1
SCHEMBL29328704 0.85 PPARA (0.63) PPARAPPARGEPHX2CNR1
SCHEMBL4449661 0.85 PPARA (0.55) PPARAPPARGEPHX2FAAHCNR1
SCHEMBL26430086 0.85 PPARA (0.55) PPARAPPARGEPHX2FAAHCNR1
Bromide SCHEMBL28328576 0.84 PPARA (0.61) PPARAPPARGEPHX2CNR1
SCHEMBL29328712 0.82 PPARA (0.64) PPARAPPARGCNR1
SCHEMBL18641784 0.81 PPARA (0.57) PPARAPPARGEPHX2CNR1

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-2023187302-A1 NOVEL PLASTICIZERS, PROCESS FOR THE PREPARATION THEREOF, AND USE THEREOF ORPIA INNOVATION (FR) 2023-10-05 — — WO disclosed
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