SCHEMBL3406578

SCHEMBL3406578

CCOC[CH]SCCOCC

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL9077131 0.82 ALDH1A1 (0.39) ALDH1A1
SCHEMBL4309346 0.73
SCHEMBL2123433 0.68 ALDH1A1 (0.45) ALDH1A1
SCHEMBL7546724 0.68 ALDH1A1 (0.45) ALDH1A1
SCHEMBL7101023 0.66 ALDH1A1 (0.43) ALDH1A1
SCHEMBL12852155 0.66 ALDH1A1 (0.43) ALDH1A1
SCHEMBL18431000 0.66
SCHEMBL7056848 0.66
SCHEMBL6476012 0.65
SCHEMBL7056843 0.64

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
EP-2260032-A2 FUNGICIDAL HETERCYCLIC COMPOUNDS E. I. du Pont de Nemours and Company (US) 2010-12-15 EP disclosed
WO-2009094445-A2 FUNGICIDAL HETERCYCLIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-07-30 WO disclosed