SCHEMBL21392011

SCHEMBL21392011

CCCC/C=C/c1cccs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
HTT P42858 1/20 0.51
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
ALOX5 P09917 2/20 0.42
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
HCAR2 Q8TDS4 1/20 0.42
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
CYP1A1 P04798 2/20 0.40
CYP1B1 Q16678 2/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL3688382 1.00 MAPT (0.51) MAPTHTTALDH1A1LMNAGAA
SCHEMBL20634195 1.00 MAPT (0.51) MAPTHTTALDH1A1LMNAGAA
SCHEMBL6434868 0.95 MAPT (0.50) MAPTHTTALDH1A1LMNAGAA
SCHEMBL6434876 0.95 MAPT (0.50) MAPTHTTALDH1A1LMNAGAA
SCHEMBL23345517 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL16135282 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL15688422 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL16135275 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL2007435 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL10605933 0.93 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA

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-11094474-B2 Photoelectric conversion element, dye-sensitized solar cell, metal complex dye, dye composition, and oxide semiconductor electrode FUJIFILM CORPORATION (JP) 2021-08-17 US disclosed
US-20190295779-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE COMPOSITION, AND OXIDE SEMICONDUCTOR ELECTRODE FUJIFILM CORPORATION (JP) 2019-09-26 US disclosed