SCHEMBL8499201

SCHEMBL8499201

COc1ccc(C/C(C)=N/N(Cc2ccccc2)c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
ACHE P22303 1/20 0.46
GAA P10253 2/20 0.45
LTA4H P09960 1/20 0.45
ALOX5 P09917 1/20 0.44
NPC1 O15118 1/20 0.44
G6PC1 P35575 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL8499202 1.00 ALDH1A1 (0.46) ALDH1A1MAPTKMT2AACHEGAA
SCHEMBL8497154 0.87 MAPT (0.43) ALDH1A1MAPTKMT2AACHEGAA
SCHEMBL8497157 0.87 MAPT (0.43) ALDH1A1MAPTKMT2AACHEGAA
SCHEMBL8498475 0.85 G6PC1 (0.54) ALDH1A1MAPTKMT2AACHELTA4H
SCHEMBL8498477 0.85 G6PC1 (0.54) ALDH1A1MAPTKMT2AACHELTA4H
SCHEMBL8498652 0.83 L3MBTL1 (0.50) ALDH1A1MAPTKMT2AACHEGAA
SCHEMBL8498654 0.83 L3MBTL1 (0.50) ALDH1A1MAPTKMT2AACHEGAA
SCHEMBL8498217 0.83 ALDH1A1 (0.50) ALDH1A1MAPTKMT2AGAALTA4H
SCHEMBL8498219 0.83 ALDH1A1 (0.50) ALDH1A1MAPTKMT2AGAALTA4H
SCHEMBL8498826 0.81 G6PC1 (0.44) ALDH1A1MAPTKMT2AACHEGAA

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
WO-1999040062-A1 HYDRAZONE DERIVATIVES NOVO NORDISK A/S (DK) 1999-08-12 WO disclosed