SCHEMBL78504

SCHEMBL78504

Cc1ccc(S(=O)(=O)N[C]=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
MMP1 P03956 1/20 0.57
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 3/20 0.52
HPGD P15428 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
CYP2C9 P11712 3/20 0.52
CYP2C19 P33261 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2D6 P10635 2/20 0.52
MAPT P10636 2/20 0.52
ALOX12 P18054 2/20 0.52

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
SCHEMBL9805292 0.81 GAA (0.57) GAASMN1; SMN2CA1CA2MMP1
SCHEMBL3237620 0.81 GAA (0.57) GAASMN1; SMN2CA1CA2MMP1
SCHEMBL7364561 0.81 GAA (0.57) GAASMN1; SMN2CA1CA2MMP1
SCHEMBL9135655 0.78 MMP2 (0.57) GAACA1CA2MMP1MMP2
SCHEMBL6934611 0.78 CA1 (0.57) GAASMN1; SMN2CA1CA2MMP1
SCHEMBL423687 0.78 CA2 (0.57) CA1CA2MMP1MMP2MMP9
SCHEMBL423264 0.78 CA1 (0.57) CA1CA2MMP1MMP2MMP9
SCHEMBL5335389 0.78 MMP2 (0.61) GAASMN1; SMN2CA1CA2MMP1
SCHEMBL210772 0.77 CA1 (0.54) SMN1; SMN2CA1CA2MMP1MMP2
SCHEMBL187561 0.77 GAA (0.70) GAASMN1; SMN2CA1CA2MMP1

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

Appears in 3280 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2016044-B1 PENTACYCLINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS HARVARD COLLEGE (US) 2020-06-10 EP claimed
EP-3054958-B1 NEW PRADIMICIN DERIVATIVES FOR THE TREATMENT OF DISEASES CAUSED BY KINETOPLASTIDS UNIV LEUVEN KATH (BE) 2020-06-03 EP claimed
EP-3323414-A1 INHIBITORS OF NEDD8-ACTIVATING ENZYME Millennium Pharmaceuticals, Inc. (US) 2018-05-23 EP claimed
EP-2550285-B1 TRIOXACARCINS AND USES THEREOF HARVARD COLLEGE (US) 2017-07-19 EP claimed
EP-2621902-B1 3-AZABICYCLO[3.1.0]HEXANE COMPOUNDS USEFUL FOR THE TREATMENT OF CNS DISORDERS PANACEA BIOTEC LTD (IN) 2017-04-12 EP claimed
US-20160243140-A1 NEW PRADIMICIN DERIVATIVES FOR THE TREATMENT OF DISEASES CAUSED BY KINETOPLASTIDS KATHOLIEKE UNIVERSITEIT LEUVEN (AU) 2016-08-25 US claimed
EP-3054958-A1 NEW PRADIMICIN DERIVATIVES FOR THE TREATMENT OF DISEASES CAUSED BY KINETOPLASTIDS Katholieke Universiteit Leuven (BE) 2016-08-17 EP claimed
US-20150376201-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-12-31 US claimed
US-9133116-B2 Bicyclic compounds PANACEA BIOTEC LTD. (IN) 2015-09-15 US claimed
WO-2015051422-A1 NEW PRADIMICIN DERIVATIVES FOR THE TREATMENT OF DISEASES CAUSED BY KINETOPLASTIDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2015-04-16 WO claimed
US-20030216571-A1 Antiallergens; antiinflammatory agents UBE INDUSTRIES, LTD. (JP) 2003-11-20 US claimed
EP-1254897-A1 TRICYCLIC COMPOUNDS Ube Industries, Ltd. (JP) 2002-11-06 EP claimed
US-5994368-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, ANALGESICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-30 US claimed
EP-0807105-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-19 EP claimed
EP-0626956-B1 QUINOLYLBENZOFURAN DERIVATIVES AS LEUKOTRIENE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1997-05-07 EP claimed
US-5530124-A Method for preparing cyclic ureas and their use for the synthesis of HIV protease inhibitors THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1996-06-25 US claimed
WO-1996013485-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-09 WO claimed
US-5360928-A Synthesis and use of amino acid fluorides as peptide coupling reagents RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1994-11-01 US claimed
EP-0428132-B1 PRADIMICIN DERIVATIVES Bristol-Myers Squibb Company (US) 1993-08-04 EP claimed
EP-0428132-A1 Pradimicin derivatives Bristol-Myers Squibb Company (US) 1991-05-22 EP claimed