SCHEMBL28228

SCHEMBL28228

[CH2]C(=O)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.54
GSR P00390 2/20 0.50
AKR1C3 P42330 2/20 0.50
PTGS2 P35354 2/20 0.48
TGM2 P21980 1/20 0.47
MAOB P27338 1/20 0.46

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
SCHEMBL1381443 0.82 CA2 (0.65) ENPP2GSRAKR1C3PTGS2
SCHEMBL4321082 0.81 ENPP2 (0.58) ENPP2GSRAKR1C3PTGS2
Hydrochloric Acid SCHEMBL14482763 0.80 CA2 (0.63) ENPP2GSRAKR1C3PTGS2
SCHEMBL34837 0.79 CA2 (0.61) ENPP2GSRAKR1C3PTGS2
SCHEMBL28229 0.79 PTGS2 (0.57) ENPP2GSRAKR1C3PTGS2
SCHEMBL27470345 0.78 TGM2 (0.58) ENPP2GSRAKR1C3PTGS2TGM2
SCHEMBL10916595 0.77 ENPP2 (0.54) ENPP2GSRAKR1C3PTGS2
Hydrochloric Acid SCHEMBL11213950 0.77 CA2 (0.59) ENPP2GSRAKR1C3PTGS2
Lithium Ion SCHEMBL29035629 0.77 ENPP2 (0.54) ENPP2GSRAKR1C3PTGS2
SCHEMBL599583 0.77 ENPP2 (0.54) ENPP2GSRAKR1C3PTGS2MAOB

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 501 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101384610-B 11 beta-hydroxyandrostan-4-en-3-ones SUN PHARMA ADVANCED RES CO LTD 2013-07-17 CN claimed
EP-1514542-B1 Medicinal composition comprising Tacrine or Donepezil for improving brain function. TOYAMA CHEMICAL CO LTD (JP) 2012-02-22 EP claimed
CN-101384610-A 11 beta-hydroxyandrostan-4-en-3-ones SUN PHARMA ADVANCED RES CO LTD (IN) 2009-03-11 CN claimed
US-4751299-A Optically active β-lactams and method of their production TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-06-14 US claimed
US-4665067-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-05-12 US claimed
JP-58043954-A None JP disclosed
JP-58074669-A None JP disclosed
CN-118284608-A Compounds as BCL-2 inhibitors 重庆复创医药研究有限公司 2024-07-02 CN disclosed
CN-118215661-A Compounds as BCL-2 inhibitors 重庆复创医药研究有限公司 2024-06-18 CN disclosed
EP-4119560-B1 APOPTOSIS-INDUCING AGENTS FOCHON PHARMACEUTICALS LTD (CN) 2024-06-05 EP disclosed
EP-3768661-B1 DEUTERATED COMPOUNDS AS ROCK INHIBITORS FOCHON PHARMACEUTICALS LTD (CN) 2024-05-01 EP disclosed
US-20240108638-A1 METHODS AND RELATED COMPOSITIONS FOR REDUCTION OF FAT AND SKIN TIGHTENING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2024-04-04 US disclosed
US-4310459-A Process for producing carbamoyl substituted penams and carbamoyl substituted cephams from penicillin sulfoxide esters BRISTOL-MYERS COMPANY (US) 1982-01-12 US disclosed
US-4267340-A BACTERICIDES; SYNTHESIS OF PENICILLINS AND CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-05-12 US disclosed
EP-0021676-A1 3-Methoxy-2-oxoazetidine derivatives and their production Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
EP-0021678-A1 1-Sulpho-2-oxoazetidine derivatives, their production and pharmaceutical compositions thereof Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
US-4242507-A Sulfonic acid esters FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-12-30 US disclosed
US-4036847-A ANTIBACTERIAL FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1977-07-19 US disclosed
US-4009159-A PENICILLINS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1977-02-22 US disclosed
US-3993646-A Process for the ring expansion of penicillins to cephalosporin compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-11-23 US disclosed