SCHEMBL30200331

SCHEMBL30200331

COc1ccc(NC(=O)c2nc(-c3ccccc3)ccc2C)cc1S(=O)(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 12/20 0.55
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
GAA P10253 1/20 0.52
ALPL P05186 1/20 0.51
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PIK3CD O00329 1/20 0.49
PIK3CA P42336 1/20 0.49
PIK3CG P48736 1/20 0.49
PTPN2 P17706 1/20 0.49
PTPN1 P18031 1/20 0.49
PTPN5 P54829 1/20 0.49

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
SCHEMBL23833747 1.00 IDH1 (0.55) IDH1MEN1MAPTKMT2AGAA
SCHEMBL25755201 0.85 IDH1 (0.57) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23846615 0.84 MEN1 (0.52) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23846387 0.80 PTPN2 (0.59) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23846390 0.79 MAPT (0.62) IDH1MEN1MAPTKMT2AGAA
SCHEMBL25757314 0.78 PTPN2 (0.57) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23846617 0.78 MAPT (0.56) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23846622 0.78 MEN1 (0.53) IDH1MEN1MAPTKMT2AGAA
SCHEMBL30199611 0.78 MAPT (0.53) IDH1MEN1MAPTKMT2AGAA
SCHEMBL23833746 0.78 MAPT (0.53) IDH1MEN1MAPTKMT2AGAA

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
EP-4121029-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF Amathus Therapeutics, Inc. (US) 2023-01-25 EP disclosed