SCHEMBL13623202

SCHEMBL13623202

C=C1CCCCCCCCCCOCCCCO1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL13716870 0.92 CA1 (0.43) CA1CA9
SCHEMBL16407634 0.92 CA1 (0.43) CA1CA9
SCHEMBL12201161 0.92
SCHEMBL17987899 0.92 CA1 (0.43) CA1CA9
SCHEMBL761230 0.89
SCHEMBL548341 0.81
SCHEMBL17178109 0.79 CA1 (0.34) CA1CA9
SCHEMBL17178106 0.79 CA1 (0.34) CA1CA9
SCHEMBL30928349 0.72
SCHEMBL24983738 0.70 CA1 (0.80) ALDH1A1CA1CA9

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-7618141-B2 Polymerizable composition containing an odor masking agent and a perfume, an optical lens and a production method ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2009-11-17 US disclosed
US-20080013042-A1 Polymerizable Composition Containing An Odor Masking Agent And A Perfume, An Optical Lens And A Production Method ESSILOR INTERNATIONAL (FR) 2008-01-17 US disclosed