SCHEMBL12866117

SCHEMBL12866117

C[n+]1c(/C=C/c2ccc(O)c(O)c2O)sc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 3/20 0.59
▸ ADRB1 P08588 2/20 0.59
▸ INSR P06213 11/20 0.53
▸ POLB P06746 4/20 0.51
▸ MAPT P10636 4/20 0.51
▸ NPSR1 Q6W5P4 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ HTT P42858 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ SNCA P37840 1/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ RAD52 P43351 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL12866110 0.89 ADRB2 (0.63) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL13005225 0.84 INSR (0.57) INSRPOLBMAPTNPSR1SMN1; SMN2
SCHEMBL12866120 0.82 MAPT (0.59) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL12866113 0.78 INSR (0.58) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL12866119 0.78 ADRB2 (0.56) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL12866109 0.77 INSR (0.60) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL12866121 0.74 INSR (0.59) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL12880684 0.73 INSR (0.54) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL14561804 0.73 ADRB2 (0.61) ADRB2ADRB1INSRPOLBMAPT
SCHEMBL16800095 0.73 ADRB2 (0.61) ADRB2ADRB1INSRPOLBMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338700-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 — — US disclosed
US-8338701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 — — US disclosed
US-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 — — US disclosed
US-20110031446-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 — — US disclosed
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