SCHEMBL13005219

SCHEMBL13005219

CC[n+]1c(/C=C/c2ccc(O)c(O)c2)sc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 9/20 0.64
▸ APP P05067 2/20 0.55
▸ KMT2A Q03164 6/20 0.53
▸ HTT P42858 5/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ PKM P14618 2/20 0.53
▸ BLM P54132 2/20 0.53
▸ POLB P06746 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ OPRK1 P41145 1/20 0.53
▸ MAPT P10636 5/20 0.52
▸ THRB P10828 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MMP14 P50281 1/20 0.52
▸ NPC1 O15118 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ NSD2 O96028 1/20 0.51
▸ MAPK1 P28482 1/20 0.51

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
SCHEMBL12880679 0.88 INSR (0.62) INSRAPPKMT2AHTTMEN1
SCHEMBL29105316 0.87 KMT2A (0.69) INSRAPPKMT2AHTTMEN1
Bromide SCHEMBL17311241 0.86 KMT2A (0.68) INSRAPPKMT2AHTTMEN1
SCHEMBL34468132 0.85 INSR (0.72) INSRAPPKMT2AHTTMEN1
SCHEMBL12880678 0.84 INSR (0.63) INSRAPPKMT2AHTTMEN1
Iodide SCHEMBL12470899 0.84 INSR (0.70) INSRAPPKMT2AHTTMEN1
SCHEMBL12866109 0.84 INSR (0.60) INSRKMT2AHTTMEN1L3MBTL1
SCHEMBL17322556 0.82 INSR (0.75) INSRAPPKMT2AHTTMEN1
SCHEMBL13005216 0.80 INSR (0.57) INSRAPPKMT2AHTTMEN1
SCHEMBL13005225 0.80 INSR (0.57) INSRAPPKMT2AHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 — — US disclosed
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