SCHEMBL12880677

SCHEMBL12880677

CC[n+]1c(/C=C/c2ccc(O)cc2O)sc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 2/20 0.53
▸ KMT2A Q03164 9/20 0.51
▸ MAPT P10636 8/20 0.51
▸ MEN1 O00255 8/20 0.51
▸ HTT P42858 6/20 0.51
▸ THRB P10828 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ MMP14 P50281 1/20 0.51
▸ APP P05067 2/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ ALOX12 P18054 2/20 0.47
▸ CTNNB1 P35222 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ BLM P54132 3/20 0.46
▸ RAB9A P51151 7/20 0.45
▸ NPC1 O15118 6/20 0.45

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
Bromide SCHEMBL17311242 0.87 MEN1 (0.55) INSRKMT2AMAPTMEN1HTT
SCHEMBL12866120 0.84 MAPT (0.59) INSRKMT2AMAPTMEN1HTT
SCHEMBL13005225 0.84 INSR (0.57) INSRKMT2AMAPTMEN1HTT
SCHEMBL34468132 0.82 INSR (0.72) INSRKMT2AMAPTMEN1HTT
SCHEMBL12880684 0.81 INSR (0.54) INSRKMT2AMAPTMEN1HTT
SCHEMBL12880678 0.81 INSR (0.63) INSRKMT2AMAPTMEN1HTT
Iodide SCHEMBL12470899 0.81 INSR (0.70) INSRKMT2AMAPTMEN1HTT
SCHEMBL12880679 0.80 INSR (0.62) INSRKMT2AMAPTMEN1HTT
SCHEMBL13005216 0.79 INSR (0.57) INSRKMT2AMAPTMEN1HTT
SCHEMBL13005219 0.79 INSR (0.64) INSRKMT2AMAPTMEN1HTT

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 3 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-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 — — US disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 — — US disclosed
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