SCHEMBL14748770

SCHEMBL14748770

COCCOCC1COc2cscc2O1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
TSHR P16473 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 3/20 0.33
S1PR1 P21453 2/20 0.32
SGPL1 O95470 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 2/20 0.31
CYP2C19 P33261 2/20 0.31
KMT2A Q03164 2/20 0.31
HTR1A P08908 3/20 0.30
ADRA1D P25100 3/20 0.30
ADRA1A P35348 3/20 0.30
ADRA1B P35368 3/20 0.30
MAPK1 P28482 2/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
THPO P40225 1/20 0.30
ADRA2A P08913 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
SCHEMBL28676828 0.99 ALDH1A1 (0.33) ALDH1A1TSHRSMN1; SMN2CYP2D6S1PR1
SCHEMBL23822909 0.99 ALDH1A1 (0.33) ALDH1A1TSHRSMN1; SMN2CYP2D6S1PR1
SCHEMBL1633925 0.99 ALDH1A1 (0.33) ALDH1A1TSHRSMN1; SMN2CYP2D6S1PR1
SCHEMBL14188552 0.88 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL13321811 0.87 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL20348449 0.87 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL4257289 0.87 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL4269337 0.86 L3MBTL1 (0.33) ALDH1A1CYP2D6CYP2C19MAPK1CYP1A2
SCHEMBL5895577 0.84 TSHR (0.37) ALDH1A1TSHRSMN1; SMN2CYP2D6TDP1
SCHEMBL13321812 0.84 CYP2D6 (0.32) ALDH1A1CYP2D6S1PR1SGPL1CYP2C19

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-20130056074-A1 DYE-SENSITIZED SOLAR CELL AND PRODUCTION METHOD OF THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-07 US disclosed
US-20130056074-A1 DYE-SENSITIZED SOLAR CELL AND PRODUCTION METHOD OF THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-07 US disclosed