SCHEMBL17397937

SCHEMBL17397937

Cc1cc(Nc2nc(Cl)ccc2S(=O)(=O)c2ccccc2)nn1C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 10/20 0.43
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ PKM P14618 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ NMT1 P30419 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL17397933 0.80 ITK (0.41) HTR6KDM4EALDH1A1PKMSMN1; SMN2
SCHEMBL17398026 0.78 ITK (0.48) HTR6KDM4EALDH1A1PKMSMN1; SMN2
SCHEMBL17398060 0.78 AURKA (0.46) —
SCHEMBL17397982 0.76 ALDH1A1 (0.43) HTR6KDM4EALDH1A1PKMSMN1; SMN2
SCHEMBL17398031 0.75 KDM4E (0.44) KDM4EALDH1A1PKMSMN1; SMN2HTT
SCHEMBL17398079 0.73 KMT2A (0.39) HTR6KDM4EALDH1A1PKMSMN1; SMN2
SCHEMBL17398012 0.73 ALDH1A1 (0.48) HTR6ALDH1A1PKMSMN1; SMN2HTT
SCHEMBL17398018 0.72 MAPT (0.44) KDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL17398074 0.72 WDR5 (0.43) HTR6GAAKMT2A
SCHEMBL17397958 0.72 ITK (0.46) HTR6KDM4EALDH1A1PKMSMN1; SMN2

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-2016001341-A1 SULFONYLAMINOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2016-01-07 — — WO disclosed
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