SCHEMBL9103459

SCHEMBL9103459

CCCCCCCCCCCC[C]c1ccc(O)c(OC)c1CCCCCCCCCCCC

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 15/20 0.51
TYR P14679 1/20 0.40
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL9101386 0.78 ALOX5 (0.59) ALOX5TRPV1
SCHEMBL28032423 0.75 ALOX5 (0.53) ALOX5TYRTRPV1
SCHEMBL27531185 0.74 ALOX5 (0.54) ALOX5TYRTRPV1
SCHEMBL31558743 0.73 PPARA (0.54) ALOX5TRPV1
SCHEMBL2047272 0.73 PPARA (0.54) ALOX5TRPV1
SCHEMBL25231902 0.73 PPARA (0.54) ALOX5TRPV1
SCHEMBL9102101 0.73 SMPD1 (0.40)
SCHEMBL23630667 0.72 ALOX5 (0.51) ALOX5TRPV1
SCHEMBL8210818 0.72 ALOX5 (0.51) ALOX5TRPV1
SCHEMBL15914612 0.71 ALOX5 (0.50) ALOX5TYRTRPV1

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
EP-1635777-B1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GMBH (DE) 2012-06-06 EP claimed