SCHEMBL9718444

SCHEMBL9718444

O=C1C=CC(=O)N1c1cccc(S(=O)(=O)c2cccc(N3C(=O)C=CC3=O)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 12/20 0.67
FAAH O00519 6/20 0.67
HSP90AA1 P07900 3/20 0.56
ALDH1A1 P00352 1/20 0.55
PKM P14618 1/20 0.55
HTT P42858 1/20 0.55
ATM Q13315 1/20 0.55
HPN P05981 1/20 0.50
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
HTR6 P50406 1/20 0.45
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL30408507 1.00 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL2124055 1.00 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL2122028 0.87 MGLL (0.57) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL32665063 0.85 MGLL (0.62) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL28752515 0.85 CA1 (0.62) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL29510588 0.85 CA1 (0.62) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL21152567 0.83 MGLL (0.46) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL94730 0.81 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL1838889 0.81 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL30958998 0.79 MGLL (0.95) MGLLFAAHHSP90AA1ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510477-A1 Composition of polyarylene sulphides, dolomite and maleimides BAYER AG (DE) 1992-10-28 EP disclosed
EP-0443125-A1 Blends of polyarylene sulphides, metal salts, glass fibres and maleimides BAYER AG (DE) 1991-08-28 EP disclosed
EP-0396935-A2 Blends of polyarylenesulfides, glassfibres and maleimides BAYER AG (DE) 1990-11-14 EP disclosed