SCHEMBL17398031

SCHEMBL17398031

O=S(=O)(c1ccccc1)c1ccc(Cl)nc1Nc1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.44
▸ GAA P10253 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ MET P08581 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MAT2A P31153 1/20 0.40
▸ CYP1A2 P05177 3/20 0.39
▸ CYP2C19 P33261 3/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ TCF4 P15884 1/20 0.39

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
SCHEMBL17397982 0.82 ALDH1A1 (0.43) KDM4EHTTMEN1KMT2ASMN1; SMN2
SCHEMBL17398026 0.79 ITK (0.48) KDM4EGAAHTTMEN1KMT2A
SCHEMBL17398060 0.79 AURKA (0.46) —
SCHEMBL17398074 0.78 WDR5 (0.43) GAAKMT2ALMNA
SCHEMBL17398027 0.76 KDM4E (0.50) KDM4EGAAHTTMEN1KMT2A
SCHEMBL17397937 0.75 HTR6 (0.43) KDM4EGAAHTTKMT2ASMN1; SMN2
SCHEMBL17397958 0.75 ITK (0.46) KDM4EHTTMEN1KMT2ASMN1; SMN2
SCHEMBL17398018 0.75 MAPT (0.44) KDM4EGAASMN1; SMN2LMNAALDH1A1
SCHEMBL17397920 0.74 ALDH1A1 (0.50) HTTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL17398012 0.74 ALDH1A1 (0.48) GAAHTTMEN1KMT2ASMN1; 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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