SCHEMBL7253284

SCHEMBL7253284

N#CC(NC(=O)c1snc(Cl)c1Cl)c1ccoc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX5 P09917 1/20 0.31

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
SCHEMBL7067325 0.83 ALDH1A1 (0.47) ALDH1A1HTTSMN1; SMN2
SCHEMBL8802116 0.74 RAB9A (0.42) ALDH1A1HTTSMN1; SMN2
SCHEMBL8799758 0.71 CTSV (0.33) ALDH1A1HTTALOX5
SCHEMBL7067322 0.70 ALDH1A1 (0.36) ALDH1A1HTTSMN1; SMN2
SCHEMBL10653239 0.69 CTSL (0.43) ALDH1A1HTTSMN1; SMN2
SCHEMBL7978191 0.66 THRB (0.51) ALDH1A1
SCHEMBL10657793 0.65 SMYD3 (0.45) ALDH1A1
SCHEMBL14382722 0.65 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2
SCHEMBL7073731 0.63 ALDH1A1 (0.37) ALDH1A1HTTSMN1; SMN2
SCHEMBL7254054 0.63 HCAR2 (0.49) ALDH1A1HTTSMN1; SMN2ALOX5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6552056-B2 Bactericides; fungicides; miticides; nematocides; for agriculture NIHON BAYER AGROCHEM K.K. (JP) 2003-04-22 US disclosed
EP-1185519-A1 ISOTHIAZOLECARBOXAMIDES AND THEIR USE AS MICROBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2002-03-13 EP disclosed
WO-2000073290-A1 ISOTHIAZOLECARBOXAMIDES AND THEIR USE AS MICROBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2000-12-07 WO disclosed