SCHEMBL1573668

SCHEMBL1573668

CN(C)CCC(O)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31

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
SCHEMBL28578016 0.92
SCHEMBL2095196 0.78 THRB (0.38) ALDH1A1
SCHEMBL1573494 0.77 NPSR1 (0.39) HTR2A
SCHEMBL29003666 0.77
SCHEMBL353734 0.76 TP53 (0.34) ALDH1A1MAPTHTR2AHRH1
SCHEMBL9289667 0.76 CA5A (0.33)
SCHEMBL15038796 0.75 CA1 (0.31)
SCHEMBL918205 0.74 ALDH1A1 (0.31) ALDH1A1MAPTHTR2AHRH1
Water SCHEMBL27934112 0.74 TP53 (0.33) ALDH1A1MAPTHTR2AHRH1
SCHEMBL23501717 0.73 CA5A (0.31)

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-2025743-B1 Hard surface cleaning compostion PROCTER & GAMBLE (US) 2011-04-13 EP claimed