SCHEMBL10695224

SCHEMBL10695224

N#C/C(N)=C(C#N)\N=C\c1ccccc1Cl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
GAA P10253 3/20 0.70
KDM4E B2RXH2 1/20 0.70
MAPT P10636 3/20 0.58
GRIN1 Q05586 3/20 0.49
GRIN2B Q13224 3/20 0.49
GRIN2D O15399 2/20 0.49
GRIN3B O60391 2/20 0.49
GRIN2A Q12879 2/20 0.49
GRIN2C Q14957 2/20 0.49
GRIN3A Q8TCU5 2/20 0.49
TRPA1 O75762 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HBB P68871 1/20 0.45
HPGD P15428 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
SCHEMBL10695228 1.00 ALDH1A1 (0.70) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10695231 1.00 ALDH1A1 (0.70) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10696561 0.83 MAPT (0.61) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10696551 0.83 MAPT (0.61) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10696555 0.83 MAPT (0.61) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL8645205 0.83 GAA (0.52) ALDH1A1GAAKDM4EMAPTNPC1
SCHEMBL10694192 0.81 GAA (0.51) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10695223 0.81 MAPT (0.51) ALDH1A1GAAKDM4EMAPTNPC1
SCHEMBL10694188 0.81 GAA (0.51) ALDH1A1GAAKDM4EMAPTGRIN1
SCHEMBL10694197 0.81 GAA (0.51) ALDH1A1GAAKDM4EMAPTGRIN1

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-0269238-A1 Imidazoles and their compositions for plant growth regulation MAY & BAKER LIMITED (GB) 1988-06-01 EP disclosed