SCHEMBL11073015

SCHEMBL11073015

CCCCc1cc(CCCC(=O)OCC)cc(CCCC)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4Z1 Q86W10 2/20 0.47
CYP4F11 Q9HBI6 1/20 0.47
CYP4F12 Q9HCS2 1/20 0.47
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
CYP1A2 P05177 2/20 0.45
ALOX5 P09917 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK1 P28482 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 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
SCHEMBL7047486 0.93 CYP4F2 (0.50) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL18269260 0.85 DGKA (0.47) CYP4F2CYP4A11ALOX5TDP1ALDH1A1
Ethylene SCHEMBL9418228 0.82 ALOX5 (0.45) CYP4F2CYP4A11ALOX5TDP1ALDH1A1
SCHEMBL13267547 0.82 ALOX5 (0.45) CYP4F2CYP4A11ALOX5TDP1ALDH1A1
SCHEMBL11078597 0.82 DGKA (0.57) DGKA
SCHEMBL8335158 0.81 ALOX5 (0.39) CYP4F2CYP4A11ALOX5MAPK1NPSR1
SCHEMBL201692 0.80 NPC1 (0.57) ALOX5CYP3A4MAPK1NPSR1NPC1
SCHEMBL14244988 0.80 DGKA (0.50) DGKA
SCHEMBL14244745 0.80 DGKA (0.50) DGKA
SCHEMBL14245258 0.80 DGKA (0.50) DGKA

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
US-4434122-A OF POLYARYLENE SULFIDE RESINS BY ADDITION OF PHENOLIC AMIDE OR ESTER ANTIOXIDANT PHILLIPS PETROLEUM COMPANY (US) 1984-02-28 US disclosed
EP-0094092-A1 Stabilized poly(arylene sulfide) composition, process for melt extruding such composition and use of phenolic stabilizers in poly(arylene sulfide) resin PHILLIPS PETROLEUM COMPANY (US) 1983-11-16 EP disclosed