SCHEMBL12860769

SCHEMBL12860769

CCCC(CC)CC(C)N=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
TRPA1 O75762 1/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL24760654 0.91 CA12 (0.31)
SCHEMBL13525846 0.84
SCHEMBL14040440 0.82 CA2 (0.31) TRPA1TRPV1
SCHEMBL2633252 0.77 CA2 (0.31)
SCHEMBL4267030 0.75
SCHEMBL14614830 0.75
SCHEMBL13073778 0.75
SCHEMBL4279899 0.74 ALDH1A1 (0.39) ALDH1A1CYP3A4TSHR
SCHEMBL3100472 0.73 CA2 (0.32) ALDH1A1CYP3A4TSHR
SCHEMBL598883 0.72 ALDH1A1 (0.35) ALDH1A1CYP3A4TSHR

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-2288237-A2 Lighting circuit and illumination device Toshiba Lighting & Technology Corporation (JP) 2011-02-23 EP disclosed