SCHEMBL6582618

SCHEMBL6582618

CCOc1cc(C)ccc1S(N)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.51
CA2 P00918 4/20 0.51
CA9 Q16790 4/20 0.51
CA12 O43570 3/20 0.51
CA14 Q9ULX7 1/20 0.51
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TSHR P16473 4/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 1/20 0.46
PDIA6 Q15084 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TRPV4 Q9HBA0 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CA7 P43166 1/20 0.43
NPC1 O15118 1/20 0.42
ALPL P05186 1/20 0.42
MAPT P10636 3/20 0.42

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
SCHEMBL31536847 1.00 CA1 (0.51) CA1CA2CA9CA12CA14
SCHEMBL29469925 0.86 MEN1 (0.58) CA1CA2CA9CA12CA14
SCHEMBL25045969 0.83 TRPV4 (0.63) CA1CA2CA9MEN1KMT2A
SCHEMBL10035006 0.83 KDM4E (0.53) CA1CA2CA9CA12CA14
SCHEMBL25045972 0.83 MEN1 (0.48) MEN1KMT2ATSHRPOLBMAPK1
SCHEMBL6587523 0.82 PDIA6 (0.45) CA1CA2CA9MEN1KMT2A
SCHEMBL29588407 0.81 CA12 (0.50) CA1CA2CA9CA12CA14
SCHEMBL22587747 0.81 CA12 (0.50) CA1CA2CA9CA12CA14
SCHEMBL20505498 0.81 LMNA (0.57) CA1CA2CA9CA12CA14
SCHEMBL21815478 0.81 MEN1 (0.47) CA1CA2CA9MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106000270-B The curing agent special reaction device and its production method of a kind of repairing heavy metal in soil pollution 徐州工程学院 2017-09-15 CN claimed
CN-106377150-A Intelligent curtain control system based on technology of Internet of things and operation method thereof 江苏建筑职业技术学院 2017-02-08 CN claimed
CN-106000270-A Special reaction device for curing agent for repair of soil heavy metal pollution and production method thereof 徐州工程学院 2016-10-12 CN claimed
CN-106377150-A Intelligent curtain control system based on technology of Internet of things and operation method thereof 江苏建筑职业技术学院 2017-02-08 CN disclosed
CN-106000270-A Special reaction device for curing agent for repair of soil heavy metal pollution and production method thereof 徐州工程学院 2016-10-12 CN disclosed
US-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES HUTCHINSON ALAN J (US) 2011-11-17 US disclosed
US-7863454-B2 3-substituted-6-aryl pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-01-04 US disclosed
US-20090176980-A1 3-Substituted-6-Aryl Pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-07-09 US disclosed
US-7342115-B2 Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology NEUROGEN CORPORATION (US) 2008-03-11 US disclosed
EP-0901470-B1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER (US) 2004-03-31 EP disclosed
US-6384070-B2 RESTENOSIS, KIDNEY DISEASES, LUNG DISEASES PFIZER INC. 2002-05-07 US disclosed
US-6306852-B1 INDOLE DERIVATIVES USEFUL IN THE TREATMENT OF A VARIETY OF DISEASES INCLUDING RESTENOSIS, RENAL FAILURE AND PULMONARY HYPERTENSION, AND TO PHARMACEUTICAL FORMULATIONS CONTAINING SUCH COMPOUNDS. PFIZER INC. 2001-10-23 US disclosed
US-20010014677-A1 Restenosis, kidney diseases, lung diseases RAWSON DAVID JAMES (GB) 2001-08-16 US disclosed
US-6136843-A CARDIOVASCULAR DISORDERS; KIDNEY DISORDERS PFIZER INC (US) 2000-10-24 US disclosed
US-6017945-A USEFUL IN THE TREATMENT OF RESTENOSIS, RENAL FAILURE AND PULMONARY HYPERTENSION PFIZER INC. (US) 2000-01-25 US disclosed
EP-0901470-A1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER INC. (US) 1999-03-17 EP disclosed
WO-1997043260-A1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER INC. (US) 1997-11-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES C3AR1, C5AR1, C5AR2 CA1 4840/4885CA2 4083/4885CA9 3354/4885
US-20010014677-A1 Restenosis, kidney diseases, lung diseases NR1H2, NR1H3, NR1H4 CA1 4690/4885CA2 3952/4885CA9 1502/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 CA1 4840/4885CA2 4083/4885CA9 3354/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.