SCHEMBL8055459

SCHEMBL8055459

CC(C)(C)[S+]([O-])c1ccccc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.42
MAPT P10636 4/20 0.42
HPGD P15428 3/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
METAP2 P50579 1/20 0.40
GAA P10253 2/20 0.40
USP2 O75604 1/20 0.40
BCAT2 O15382 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
TNIK Q9UKE5 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.36
CTNNB1 P35222 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
AHR P35869 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL20214599 0.82 KDM4E (0.42) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL6228527 0.79 KDM4E (0.47) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL7225253 0.79 GAA (0.47) GAAKMT2ANPC1RAB9A
SCHEMBL20877639 0.76 GPR3 (0.40) ALDH1A1TSHR
SCHEMBL20877679 0.76 GPR3 (0.40) ALDH1A1TSHR
SCHEMBL7217598 0.76 HSP90AA1 (0.46) ALDH1A1MAPTHPGDTSHRLMNA
SCHEMBL7217674 0.76 HPGD (0.53) KDM4EALDH1A1HPGDHSD17B10METAP2
SCHEMBL8055106 0.75 ALDH1A1 (0.42) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL8054028 0.75 IRAK4 (0.46) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL7217956 0.73 CES2 (0.40) MAPTGAALMNAKMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108003113-B Synthetic method of medicine for treating diabetes 上海工程技术大学 2021-06-11 CN claimed
EP-0751123-B1 Method for producing alkylsulfinylbenzamides SUMITOMO SEIKA CHEMICALS (JP) 2000-05-10 EP claimed
CN-1215721-A Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS (JP) 1999-05-05 CN claimed
US-5744609-A REACTING AN ALKYLTHIOBENZAMIDE WITH A HALOGEN IN A HETEROGENOUS SOLVENT TO GIVE ALKYLSULFURYLBENZAMIDES INTERMEDIATES; USEFUL ANTIBACTERIAL AND ANTIFUNGAL AGENT SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1998-04-28 US claimed
EP-0751123-A2 Method for producing alkylsulfinylbenzamides SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-01-02 EP claimed
CN-1107837-A Process for producing alkylsulfinylbenzamides and 1, 2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS (JP) 1995-09-06 CN claimed
EP-0657438-A2 Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1995-06-14 EP claimed
CN-108003113-B Synthetic method of medicine for treating diabetes 上海工程技术大学 2021-06-11 CN disclosed
CN-108003113-B Synthetic method of medicine for treating diabetes 上海工程技术大学 2021-06-11 CN disclosed
CN-1086693-C Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICAL CO LTD (JP) 2002-06-26 CN disclosed
EP-0751123-B1 Method for producing alkylsulfinylbenzamides SUMITOMO SEIKA CHEMICALS (JP) 2000-05-10 EP disclosed
CN-1215721-A Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS (JP) 1999-05-05 CN disclosed
CN-1215722-A Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS (JP) 1999-05-05 CN disclosed
CN-1042530-C Process for producing alkylsulfinylbenzamides SUMITOMO SEIKA CHEMICALS (JP) 1999-03-17 CN disclosed
US-5744609-A REACTING AN ALKYLTHIOBENZAMIDE WITH A HALOGEN IN A HETEROGENOUS SOLVENT TO GIVE ALKYLSULFURYLBENZAMIDES INTERMEDIATES; USEFUL ANTIBACTERIAL AND ANTIFUNGAL AGENT SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1998-04-28 US disclosed
US-5672751-A TREATMENT OF A HALOBENZAMIDE WITH AN ALKANETHIOL IN THE PRESENCE OF A PHASE TRANSFER CATALYST SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-09-30 US disclosed
EP-0751123-A2 Method for producing alkylsulfinylbenzamides SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-01-02 EP disclosed
US-5508416-A HALOGENATING A 2-(ALKYLTHIO)BENZAMIDE, CYCLIZATION TO HETERO RING AND N-S LINKAGE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1996-04-16 US disclosed
CN-1107837-A Process for producing alkylsulfinylbenzamides and 1, 2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS (JP) 1995-09-06 CN disclosed
EP-0657438-A2 Method for producing alkylsulfinylbenzamides and 1,2-benzisothiazol-3-ones SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1995-06-14 EP disclosed