SCHEMBL12674812

SCHEMBL12674812

O=S(=O)(Nc1nc2cc(Cl)ccc2o1)c1cccc(S(=O)(=O)N2CCCCC2)c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 19/20 0.71
▸ MEN1 O00255 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ KMT2A Q03164 1/20 0.51

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
SCHEMBL17479721 0.80 MAPK1 (0.56) FBP1MEN1ALDH1A1KMT2A
SCHEMBL8119094 0.73 FBP1 (0.74) FBP1
SCHEMBL8120455 0.73 FBP1 (0.74) FBP1
SCHEMBL23752330 0.73 FBP1 (1.00) FBP1
SCHEMBL4555970 0.72 ALDH1A1 (0.97) MEN1ALDH1A1KMT2A
SCHEMBL31684032 0.72 ALDH1A1 (0.97) MEN1ALDH1A1KMT2A
SCHEMBL15010078 0.70 ALDH1A1 (1.00) MEN1ALDH1A1KMT2A
SCHEMBL8119318 0.69 FBP1 (0.78) FBP1MEN1KMT2A
SCHEMBL27827052 0.69 FBP1 (0.86) FBP1
SCHEMBL12674490 0.68 ALDH1A1 (0.55) MEN1ALDH1A1KMT2A

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-2011059042-A1 AROMATIC RING COMPOUND 武田薬品工業株式会社 (JP) 2011-05-19 — — WO disclosed
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