SCHEMBL6660239

SCHEMBL6660239

COS(=O)(=O)CC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.53
HSD11B1 P28845 7/20 0.53
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 3/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
CES1 P23141 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GSK3B P49841 2/20 0.45
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
TRPA1 O75762 1/20 0.45
HIF1A Q16665 1/20 0.45

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
SCHEMBL6659940 0.81 RECQL (0.50) RECQLHSD11B1LMNAPOLBKMT2A
SCHEMBL6660055 0.80 RECQL (0.49) RECQLHSD11B1LMNAPOLBKMT2A
SCHEMBL4750334 0.79 RECQL (0.47) RECQLHSD11B1LMNAKMT2AMAPK1
SCHEMBL6664422 0.79 KMT2A (0.52) RECQLHSD11B1LMNAKMT2AMAPK1
SCHEMBL1699941 0.78 RECQL (0.58) RECQLHSD11B1LMNAKMT2AMAPK1
SCHEMBL1516246 0.77 MAPK1 (0.58) RECQLHSD11B1LMNAKMT2AMAPK1
SCHEMBL8761020 0.76 RECQL (0.56) RECQLHSD11B1LMNAKMT2AMAPK1
SCHEMBL15299031 0.75 KMT2A (0.56) RECQLHSD11B1LMNAPOLBKMT2A
SCHEMBL137832 0.75 MAPK1 (0.56) RECQLHSD11B1LMNAKMT2AMAPK1
Acetic Acid SCHEMBL28778736 0.74 RECQL (0.54) RECQLHSD11B1LMNAKMT2AMAPK1

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