SCHEMBL12880679

SCHEMBL12880679

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 5/20 0.62
▸ KMT2A Q03164 7/20 0.53
▸ MAPT P10636 6/20 0.53
▸ HTT P42858 6/20 0.53
▸ MEN1 O00255 6/20 0.53
▸ THRB P10828 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MMP14 P50281 1/20 0.53
▸ APP P05067 2/20 0.53
▸ RAB9A P51151 4/20 0.49
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ PKM P14618 2/20 0.49
▸ NSD2 O96028 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ BLM P54132 3/20 0.48
▸ POLB P06746 3/20 0.48

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
SCHEMBL13005219 0.88 INSR (0.64) INSRKMT2AMAPTHTTMEN1
SCHEMBL12880678 0.88 INSR (0.63) INSRKMT2AMAPTHTTMEN1
SCHEMBL17325581 0.85 KMT2A (0.57) INSRKMT2AMAPTHTTMEN1
Bromide SCHEMBL17311237 0.84 KMT2A (0.56) INSRKMT2AMAPTHTTMEN1
SCHEMBL34468132 0.84 INSR (0.72) INSRKMT2AMAPTHTTMEN1
SCHEMBL12866113 0.83 INSR (0.58) INSRKMT2AMAPTHTTMEN1
SCHEMBL17322556 0.83 INSR (0.75) INSRKMT2AMAPTHTTMEN1
Iodide SCHEMBL12470899 0.83 INSR (0.70) INSRKMT2AMAPTHTTMEN1
SCHEMBL13005216 0.81 INSR (0.57) INSRKMT2AMAPTHTTMEN1
SCHEMBL29105316 0.81 KMT2A (0.69) INSRKMT2AMAPTHTTMEN1

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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