SCHEMBL4888046

SCHEMBL4888046

C1CCOCC1.C1CCOCC1.COC(OC)OC(OC)OC

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
Tetrahydrofuran SCHEMBL3866495 0.86 ALDH1A1 (0.50) ALDH1A1
Dioxane SCHEMBL4888055 0.86 TTR (0.38)
Methoxymethane SCHEMBL9829152 0.76
SCHEMBL28247936 0.76 ALDH1A1 (0.44) ALDH1A1
SCHEMBL3423848 0.76 ALDH1A1 (0.44) ALDH1A1
Dioxane SCHEMBL6985191 0.74 TTR (0.43)
Tetrahydrofuran SCHEMBL2041223 0.73
Tetrahydrofuran SCHEMBL6171686 0.72 ALDH1A1 (0.47) ALDH1A1
Tetrahydrofuran SCHEMBL9067165 0.72 ALDH1A1 (0.47) ALDH1A1
SCHEMBL6829599 0.72 ALDH1A1 (0.47) ALDH1A1

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
US-20080124641-A1 Electrophotographic photoreceptor SHARP KABUSHIKI KAISHA (JP) 2008-05-29 US disclosed