SCHEMBL6659940

SCHEMBL6659940

CCOS(=O)(=O)CC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 3/20 0.47
HSD11B1 P28845 8/20 0.46
MAPT P10636 3/20 0.45
MAPK1 P28482 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
CES1 P23141 1/20 0.45
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.43
GSK3B P49841 2/20 0.42
TRPA1 O75762 1/20 0.42
HIF1A Q16665 1/20 0.42
PTPN1 P18031 1/20 0.42

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
SCHEMBL27638550 0.83 HSD11B1 (0.56) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL6660239 0.81 RECQL (0.53) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL1699941 0.79 RECQL (0.58) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL6660055 0.77 RECQL (0.49) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL8761020 0.77 RECQL (0.56) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL4750334 0.76 RECQL (0.47) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL6664422 0.76 KMT2A (0.52) RECQLMEN1KMT2AHSD11B1MAPT
Acetic Acid SCHEMBL28778736 0.76 RECQL (0.54) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL1516246 0.74 MAPK1 (0.58) RECQLMEN1KMT2ANPC1HSD11B1
SCHEMBL28052900 0.73 LMNA (0.60) MEN1KMT2ANPC1MAPK1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1447397-A1 Polyfunctional sulfonamides and sulfonates and process for preparing them Ecole Polytechnique Fédérale de Lausanne (CH) 2004-08-18 EP claimed
EP-1447397-A1 Polyfunctional sulfonamides and sulfonates and process for preparing them Ecole Polytechnique Fédérale de Lausanne (CH) 2004-08-18 EP disclosed