SCHEMBL12866107

SCHEMBL12866107

CCOC(=O)/C(C#N)=C/c1ccc(O)c(OC=O)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.78
MAPT P10636 5/20 0.78
KMT2A Q03164 5/20 0.78
MEN1 O00255 3/20 0.78
HTT P42858 2/20 0.67
PKM P14618 1/20 0.67
DNM1 Q05193 3/20 0.58
PDCD1 Q15116 1/20 0.57
CD274 Q9NZQ7 1/20 0.57
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
KDM4E B2RXH2 3/20 0.56
PTP4A1 Q93096 2/20 0.56
MIF P14174 1/20 0.56
LMNA P02545 1/20 0.53
KLK7 P49862 1/20 0.52
ST14 Q9Y5Y6 1/20 0.52
PTP4A3 O75365 1/20 0.51
NPC1 O15118 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
SCHEMBL30883296 0.88 ALDH1A1 (1.00) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL22897308 0.88 ALDH1A1 (1.00) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL2270723 0.88 ALDH1A1 (1.00) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL9218618 0.85 DNM1 (0.80) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL9218611 0.85 DNM1 (0.80) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL17545166 0.85 DNM1 (0.80) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL31648510 0.81 MAPT (0.82) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL13005208 0.81 ALDH1A1 (0.70) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL4317761 0.80 ALDH1A1 (0.81) ALDH1A1MAPTKMT2AMEN1HTT
SCHEMBL2139678 0.80 ALDH1A1 (0.81) ALDH1A1MAPTKMT2AMEN1HTT

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