SCHEMBL13622393

SCHEMBL13622393

C=C(/N=C(/C(=O)OC)C(Cl)=C(N)N)c1ccc(C(C)=O)s1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.39
HDAC6 Q9UBN7 1/20 0.36
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
TNFRSF1A P19438 1/20 0.30

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
SCHEMBL13622389 0.88 SMN1; SMN2 (0.37) HPGDLMNA
SCHEMBL13622908 0.80 LMNA (0.41) GSK3BHPGDLMNA
SCHEMBL13256628 0.73 ALDH1A1 (0.35)
SCHEMBL13622324 0.71 NNMT (0.33)
SCHEMBL13622603 0.71 TUBB4A (0.44) HDAC6HPGDLMNA
SCHEMBL13256629 0.69 ALDH1A1 (0.32)
SCHEMBL13622400 0.67 ATAD2 (0.34) HPGDTSHR
SCHEMBL13622361 0.66 ALDH1A1 (0.39) HPGD
SCHEMBL12786330 0.66
SCHEMBL13622317 0.65 ALDH1A1 (0.38)

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-2009138712-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-11-19 WO disclosed