SCHEMBL692235

SCHEMBL692235

CCCCCC(C)S(=O)(=O)O

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.65
OPRM1 P35372 1/20 0.48
CA1 P00915 2/20 0.45
SPHK1 Q9NYA1 1/20 0.45
LAP3 P28838 2/20 0.43
LCK P06239 1/20 0.43
PPARD Q03181 1/20 0.43
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
FDPS P14324 4/20 0.41
ACE2 Q9BYF1 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
FFAR1 O14842 1/20 0.40
ZDHHC7 Q9NXF8 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL28560311 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL2053835 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL8677764 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL8971518 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL10891420 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL4662306 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL2053107 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL2052450 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL8497172 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3
SCHEMBL27568395 0.98 TP53 (0.63) TP53OPRM1CA1SPHK1LAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101801974-B Process for the manufacture of bridged monobactam intermediates BASILEA PHARMACEUTICA AG 2013-08-28 CN claimed
CN-101801974-A Process for the manufacture of bridged monobactam intermediates BASILEA PHARMACEUTICA AG 2010-08-11 CN claimed
US-5698577-A ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1997-12-16 US claimed
US-5510343-A BETA-LACTAMASE INHIBITOR HOFFMANN-LA ROCHE INC. (US) 1996-04-23 US claimed
CN-113272306-A Chemical compound 爱维斯塔制药解决方案有限公司 2021-08-17 CN disclosed
CN-104922128-B Inhibitors of influenza virus replication 沃泰克斯药物股份有限公司 2019-12-20 CN disclosed
CN-110540538-A Inhibitors of influenza virus replication VERTEX PHARMA 2019-12-06 CN disclosed
US-9757367-B2 Calcium propane-2-sulfinate dihydrate AMGEN INC. (US) 2017-09-12 US disclosed
US-9623018-B2 Processes of making and crystalline forms of a MDM2 inhibitor AMGEN INC. (US) 2017-04-18 US disclosed
CN-104940202-A Inhibitors of influenza viruses replication VERTEX PHARMA 2015-09-30 CN disclosed
CN-103724330-B The effective combined utilization of monobactams antibiotic and beta-lactamase inhibitor BASLIER PHARMACEUTICAL AG (CH) 2015-08-19 CN disclosed
CN-102458408-B Inhibitors of influenza virus replication VERTEX PHARMA 2015-06-03 CN disclosed
US-5698577-A ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1997-12-16 US disclosed
US-5691319-A ANTICARCINOGENIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-11-25 US disclosed
US-5663201-A COMPLEXES WITH IRON OR ALUMINUM CIBA-GEIGY CORPORATION (US) 1997-09-02 US disclosed
EP-0536936-B1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use SANKYO CO (JP) 1996-08-14 EP disclosed
US-5512679-A Process for the preparation of 2-aryl-ethane-sulphonic acids BAYER AKTIENGESELLSCHAFT (DE) 1996-04-30 US disclosed
US-5510343-A BETA-LACTAMASE INHIBITOR HOFFMANN-LA ROCHE INC. (US) 1996-04-23 US disclosed
EP-0536936-A1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use Sankyo Company Limited (JP) 1993-04-14 EP disclosed
EP-0075318-A2 p-Hydroxyphenylglycine alpha-phenylethanesulfonate, process for production thereof and utilization thereof in resolution of p-hydroxyphenylglycine Tanabe Seiyaku Co., Ltd. (JP) 1983-03-30 EP disclosed