SCHEMBL12866256

SCHEMBL12866256

CC1=[N+](C)c2ccccc2/C1=C/c1ccc(O)c(OC=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.49
ALDH1A1 P00352 5/20 0.49
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 5/20 0.41
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PAX8 Q06710 1/20 0.40
LCK P06239 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MIF P14174 2/20 0.39
STK17B O94768 2/20 0.39
CES2 O00748 1/20 0.39
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL12866314 0.83 LCK (0.54) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL13005261 0.81 PTPN1 (0.49) KMT2AALDH1A1MAPTL3MBTL1LCK
SCHEMBL12866255 0.71 MAPT (0.55) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL12866036 0.69 NFE2L2 (0.48) KMT2AALDH1A1MAPTMEN1ALPI
SCHEMBL1012820 0.68 ALDH1A1 (0.67) ALDH1A1MAPTPAX8TDP1HPGD
SCHEMBL12866084 0.68 MAPT (0.50) KMT2AALDH1A1MAPTMEN1ALPG
SCHEMBL16704450 0.65 TRPA1 (0.62) KMT2AALDH1A1MAPTMEN1ALPI
SCHEMBL12866037 0.65 CHAT (0.55) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL12374357 0.65 TRPA1 (0.46) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL12881902 0.64 POLB (0.52) KMT2AALDH1A1MAPTL3MBTL1MEN1

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