SCHEMBL10466652

SCHEMBL10466652

Nc1cccc2[nH]c(S(N)(=O)=O)nc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
CHEK1 O14757 1/20 0.43
CA2 P00918 4/20 0.39
PARP1 P09874 5/20 0.38
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CA12 O43570 2/20 0.37
CYP2C9 P11712 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37

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
SCHEMBL2942698 0.85 L3MBTL1 (0.56) L3MBTL1POLBTDP1MEN1GAA
SCHEMBL7477856 0.79 PARP1 (0.57) PARP1
SCHEMBL10723745 0.77 XDH (0.47) L3MBTL1POLBTDP1MEN1GAA
SCHEMBL10466702 0.77 CHEK1 (0.45) L3MBTL1POLBTDP1MEN1GAA
SCHEMBL10467865 0.76 PKN1 (0.53) TDP1MEN1GAAMAPTKMT2A
SCHEMBL3287778 0.74 MEN1 (0.58) L3MBTL1POLBTDP1MEN1GAA
SCHEMBL30291834 0.74 MEN1 (0.58) L3MBTL1POLBTDP1MEN1GAA
SCHEMBL830431 0.73 L3MBTL1 (0.68) L3MBTL1POLBMEN1GAAMAPT
SCHEMBL29815201 0.73 L3MBTL1 (0.68) L3MBTL1POLBMEN1GAAMAPT
SCHEMBL516619 0.72 NUDT1 (0.56) MAPTKMT2ACA2CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0246126-A1 Benzimidazoles and imidazopyridine sulfone amides, process for their preparation and their use as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1987-11-19 EP claimed
US-4943570-A GASTROINTESTINAL DISORDERS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1990-07-24 US disclosed
US-4933338-A ANTIULCER AGENTS, ANTISECRETORY AGENTS, TREATMENT OF GASTROINTESTINAL DISORDERS; CHEMICAL INTERMEDIATES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1990-06-12 US disclosed
EP-0246126-A1 Benzimidazoles and imidazopyridine sulfone amides, process for their preparation and their use as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1987-11-19 EP disclosed