SCHEMBL17424577

SCHEMBL17424577

CCCC=CCC=CCCCCCCCc1cccc(OCCO)c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.62
▸ PPARG P37231 3/20 0.53
▸ PTGIR P43119 1/20 0.46
▸ CYP2D6 P10635 4/20 0.46
▸ EPHX2 P34913 2/20 0.45
▸ FAAH O00519 1/20 0.45
▸ CNR1 P21554 1/20 0.45
▸ CNR2 P34972 1/20 0.45

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
SCHEMBL14520574 0.88 PPARA (0.59) PPARAPPARGPTGIRCYP2D6EPHX2
SCHEMBL6257571 0.84 PPARA (0.66) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL11320800 0.84 PPARA (0.66) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL22632071 0.83 PPARA (0.54) PPARAPPARGPTGIRCYP2D6EPHX2
SCHEMBL13206731 0.83 PPARA (0.58) PPARAPPARGEPHX2FAAHCNR1
SCHEMBL18794618 0.83 PPARA (0.59) PPARAPPARGPTGIRCYP2D6EPHX2
SCHEMBL516144 0.81 PPARA (0.57) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL31442491 0.81 CNR1 (0.51) PPARACNR1CNR2
SCHEMBL20964402 0.81 PPARA (0.52) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL26338269 0.80 PPARA (0.56) PPARAPPARGPTGIREPHX2FAAH

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-9234109-B2 Phase change inks XEROX CORPORATION (US) 2016-01-12 — — US disclosed
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