SCHEMBL12428488

SCHEMBL12428488

CC1=C/C(=N/c2ccc(O)cc2)C(N)=C(N)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 6/20 0.38
▸ CA12 O43570 5/20 0.38
▸ CA9 Q16790 5/20 0.38
▸ CA7 P43166 1/20 0.38
▸ PABPC1 P11940 2/20 0.36
▸ NOS3 P29474 1/20 0.34
▸ NOS2 P35228 1/20 0.34
▸ MAPT P10636 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ BLM P54132 3/20 0.33
▸ THRB P10828 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ PLEC Q15149 1/20 0.33
▸ CA1 P00915 4/20 0.33
▸ PTGS2 P35354 3/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ GLO1 Q04760 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ MEN1 O00255 2/20 0.32

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
SCHEMBL1154534 0.86 CA2 (0.35) CA2CA12CA9CA7PABPC1
SCHEMBL1154536 0.86 CA2 (0.35) CA2CA12CA9CA7PABPC1
SCHEMBL12052159 0.86 CA2 (0.35) CA2CA12CA9CA7PABPC1
SCHEMBL10046784 0.77 PABPC1 (0.36) CA2CA12CA9CA7PABPC1
SCHEMBL13525222 0.75 PABPC1 (0.36) CA2CA12CA9CA7PABPC1
SCHEMBL11787610 0.75 PABPC1 (0.41) CA2CA12CA9CA7PABPC1
SCHEMBL11410974 0.74 PABPC1 (0.39) CA2CA12CA9CA7PABPC1
SCHEMBL1783165 0.74 MAPT (0.38) CA2CA12CA9CA7PABPC1
SCHEMBL1154049 0.73 PABPC1 (0.35) CA2CA12CA9PABPC1NOS3
SCHEMBL12052158 0.73 PABPC1 (0.35) CA2CA12CA9PABPC1NOS3

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
EP-2229140-B1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 2-CHLORO-3-AMINO-6-METHYLPHENOL, AND HAIR DYEING METHOD STARTING FROM THESE DYES AND PRECURSORS OREAL (FR) 2011-08-03 — — EP disclosed
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