SCHEMBL9614575

SCHEMBL9614575

C=CCSC1CCCC(SCC=C)CCCC(SCC=C)CCC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 1/20 0.36
ALOX5 P09917 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL19284903 1.00
SCHEMBL9614514 0.95 TRPA1 (0.33) TRPA1ALDH1A1CYP3A4HPGDALOX15
SCHEMBL1110622 0.95
SCHEMBL1110579 0.92 TRPA1 (0.35) TRPA1ALDH1A1CYP3A4HPGDALOX15
SCHEMBL14659491 0.89
SCHEMBL29106067 0.83
SCHEMBL9614428 0.75 ALOX5 (0.32) ALOX5SMN1; SMN2
SCHEMBL21047748 0.75
SCHEMBL8643693 0.74 ALDH1A1 (0.38) ALDH1A1ALOX15ALOX5SMN1; SMN2
SCHEMBL2769573 0.72

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5096947-A Crosslinking, stabilization ATOCHEM NORTH AMERICA, INC. (US) 1992-03-17 US disclosed
US-5081169-A ORGANIC SULFIDE STABILIZED POLYMERIC ENGINEERING RESINS ATOCHEM NORTH AMERICA, INC. (US) 1992-01-14 US disclosed
US-5070124-A HEAT AND OXIDATION RESISTANCE ATOCHEM NORTH AMERICA, INC. (US) 1991-12-03 US disclosed
EP-0429878-A1 Sulfide antioxidants for stabilizing crosslinked polyolefins ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-06-05 EP disclosed
EP-0426145-A1 Organic peroxide and organic sulfide antioxidant composition ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-05-08 EP disclosed