SCHEMBL7445967

SCHEMBL7445967

O=C(Nc1ccccc1C(=O)O)c1cccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2Br)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.64
KMT2A Q03164 8/20 0.64
GAA P10253 1/20 0.64
TAS2R14 Q9NYV8 1/20 0.57
RXFP1 Q9HBX9 4/20 0.54
ACLY P53396 1/20 0.53
PPARG P37231 1/20 0.51
PPARD Q03181 1/20 0.51
PPARA Q07869 1/20 0.51
PKM P14618 1/20 0.51
APEX1 P27695 1/20 0.51
TP53 P04637 1/20 0.51
ERAP1 Q9NZ08 1/20 0.51
MCL1 Q07820 1/20 0.50
CASP6 P55212 1/20 0.50

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
SCHEMBL7453398 0.90 RXFP1 (0.54) MEN1KMT2AGAARXFP1MCL1
SCHEMBL7458365 0.89 MEN1 (0.64) MEN1KMT2AGAATAS2R14RXFP1
SCHEMBL7452313 0.86 MEN1 (0.64) MEN1KMT2AGAARXFP1ACLY
SCHEMBL7450804 0.86 MEN1 (0.76) MEN1KMT2AGAARXFP1PKM
SCHEMBL7457668 0.83 MEN1 (0.70) MEN1KMT2AGAAPPARGPPARD
SCHEMBL6720181 0.79 MEN1 (0.85) MEN1KMT2APKMAPEX1TP53
SCHEMBL7450555 0.79 MEN1 (1.00) MEN1KMT2APKMAPEX1TP53
SCHEMBL13870867 0.78 CASP3 (0.74) MEN1KMT2AACLYPPARGPPARD
SCHEMBL7454060 0.78 MEN1 (0.60) MEN1KMT2AGAATAS2R14RXFP1
SCHEMBL7445978 0.77 APEX1 (0.58) MEN1KMT2AGAARXFP1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001098274-A2 SULPHONAMIDE DERIVATIVES CELLTECH CHIROSCIENCE LIMITED (GB) 2001-12-27 WO claimed
WO-2001098274-A2 SULPHONAMIDE DERIVATIVES CELLTECH CHIROSCIENCE LIMITED (GB) 2001-12-27 WO disclosed