SCHEMBL12866113

SCHEMBL12866113

C[n+]1c(/C=C/c2cc(O)c(O)c(O)c2)sc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 12/20 0.58
▸ ADRB2 P07550 3/20 0.54
▸ ADRB1 P08588 2/20 0.54
▸ SNCA P37840 1/20 0.51
▸ POLB P06746 4/20 0.49
▸ MAPT P10636 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ THRB P10828 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ HTT P42858 3/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ NSD2 O96028 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ OPRK1 P41145 1/20 0.42

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
SCHEMBL12866109 0.87 INSR (0.60) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12866121 0.87 INSR (0.59) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12880679 0.83 INSR (0.62) INSRPOLBMAPTSMN1; SMN2NPSR1
Iodide SCHEMBL6246881 0.80 INSR (0.70) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12866119 0.79 ADRB2 (0.56) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12866110 0.78 ADRB2 (0.63) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12866117 0.78 ADRB2 (0.59) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12866120 0.77 MAPT (0.59) INSRADRB2ADRB1SNCAPOLB
SCHEMBL12881902 0.76 POLB (0.52) INSRADRB2ADRB1SNCAPOLB
SCHEMBL14561804 0.74 ADRB2 (0.61) INSRADRB2ADRB1SNCAPOLB

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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