SCHEMBL9401913

SCHEMBL9401913

Cc1[c]c(=O)n(-c2cc(Cl)c(S(=O)(=O)O)cc2Cl)[nH]1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
CASP6 P55212 1/20 0.32
MPL P40238 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL692667 0.79 MAPT (0.52) KMT2AALDH1A1MAPTCASP6MPL
SCHEMBL10400766 0.73 KDM4E (0.33) ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL1266941 0.71 ALKBH5 (0.49) KMT2AALDH1A1KDM4E
SCHEMBL8990040 0.71 ALDH1A1 (0.43) KMT2AALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL8990138 0.71 ATAD2 (0.36) KMT2AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL8990086 0.70 ALDH1A1 (0.58) KMT2AALDH1A1MAPTMPLL3MBTL1
SCHEMBL10752755 0.69 ALDH1A1 (0.51) KMT2AALDH1A1MAPTCASP6MPL
SCHEMBL4565135 0.69 CA1 (0.39) KMT2AALDH1A1CASP6L3MBTL1
SCHEMBL8990121 0.69 MAPT (0.54) KMT2AALDH1A1MAPTCASP6MPL
SCHEMBL6053229 0.69 KDM4E (0.30) ALDH1A1MAPTKDM4ESMN1; 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
US-5278292-A Aromatic sulfonyl water-soluble color materials HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-11 US disclosed