SCHEMBL258423

SCHEMBL258423

Cc1ccc(S(=O)(=O)NC(CN)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.49
CA9 Q16790 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
ATM Q13315 1/20 0.49
CA2 P00918 2/20 0.49
CA1 P00915 1/20 0.49
ALDH1A1 P00352 7/20 0.46
GAA P10253 3/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
GFER P55789 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44

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
SCHEMBL1506363 0.84 PTGES2 (0.48) CYP1A2CYP3A4CA2CA1ALDH1A1
SCHEMBL18726029 0.78 CA12 (0.54) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL3056484 0.75 CA12 (0.52) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL6819636 0.75 CA12 (0.52) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL6819477 0.75 CA12 (0.52) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL5526515 0.75 LMNA (0.48) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL5526511 0.75 LMNA (0.48) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL31039996 0.74 CA12 (0.51) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL30888830 0.74 CA12 (0.51) CA12CA9L3MBTL1CYP1A2CYP3A4
SCHEMBL3991308 0.72 CA12 (0.49) CA12CA9L3MBTL1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729266-B2 Preparation of N-alkylated opiates by reductive amination MALLINCKRODT LLC (US) 2014-05-20 US claimed
EP-2683691-B1 PROCESS FOR THE PREPARATION OF (S)-(+)-10,11-DIHYDRO-10-HYDROXY-5H-DIBENZ[b,f]AZEPINE-5-CARBOXAMIDE AND ESTERS THEREOF BY ENANTIOSELECTIVE REDUCTION OF 10,11-DIHYDRO-10-OXO-5H-DIBENZ[b,f]AZEPINE-5-CARBOXAMIDE JUBILANT LIFE SCIENCES LTD (IN) 2018-06-06 EP disclosed
US-20170190668-A1 ASYMMETRIC CATALYTIC REDUCTION OF OXCARBAZEPINE BIAL - PORTELA & C A S A (PT) 2017-07-06 US disclosed
US-9643929-B2 Asymmetric catalytic reduction of oxcarbazepine BIAL—PORTELA & CA, S.A. (PT) 2017-05-09 US disclosed
US-20160176823-A1 Asymmetric Catalytic Reduction of Oxcarbazepine BIAL PORTELA & CA SA (PT) 2016-06-23 US disclosed
US-9346760-B2 Process for the preparation of (S)-(+)- or (R)-(-)-10-hydroxy dihydrodibenz[B,F]azepines by enantioselective reduction of 10,11-dihydro-10-OXO-5H-dibenz[B,F]azepines and polymorphs thereof JUBILANT LIFE SCIENCES LIMITED (IN) 2016-05-24 US disclosed
US-9206135-B2 Asymmetric catalytic reduction of oxcarbazepine BIAL-PORTELA & CA, S.A. (PT) 2015-12-08 US disclosed
EP-2319836-B1 Asymmetric catalytic reduction of oxcarbazepine BIAL PORTELA & CA SA (PT) 2015-11-25 EP disclosed
US-8729266-B2 Preparation of N-alkylated opiates by reductive amination MALLINCKRODT LLC (US) 2014-05-20 US disclosed
EP-2683691-A2 PROCESS FOR THE PREPARATION OF (S)-(+)-OR (R)-(-)-10 HYDROXY DIHYDRODIBENZ[B,F]AZEPINES BY ENANTIOSELECTIVE REDUCTION OF 10, 11-DIHYDRO-10-OXO-5H-DIBENZ[B,F]AZEPINES AND POLYMORPHS THEREOF Jubilant Life Sciences Limited (IN) 2014-01-15 EP disclosed
EP-2152715-A1 IMPROVED PROCESS FOR THE PREPARATION OF 6-ALPHA-HYDROXY-N-ALKYLATED OPIATES Mallinckrodt Inc. (US) 2010-02-17 EP disclosed
US-20090203902-A1 Asymmetric catalytic reduction of oxcarbazepine BIAL - PORTELA & CA, S.A. (PT) 2009-08-13 US disclosed
US-20090187028-A1 Process for preparing Chiral Dipeptidyl Peptidase -IV Inhibitor Intermediates MERCK SHARP & DOHME LLC 2009-07-23 US disclosed
EP-2053032-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE HYDROXYCARBOXYLIC ACID DERIVATIVE OR SALT THEREOF Kaneka Corporation (JP) 2009-04-29 EP disclosed
WO-2009037416-A1 PROCESS FOR PREPARING SULPHONAMIDES NPIL PHARMACEUTICALS (UK) LIMITED (GB) 2009-03-26 WO disclosed
WO-2009037497-A1 PROCESS FOR PREPARING SULPHONAMIDES NPIL PHARMACEUTICALS (UK) LIMITED (GB) 2009-03-26 WO disclosed
WO-2008137672-A1 IMPROVED PROCESS FOR THE PREPARATION OF 6-ALPHA-HYDROXY-N-ALKYLATED OPIATES MALLINCKRODT INC. (US) 2008-11-13 WO disclosed
EP-1915346-A1 ASYMMETRIC CATALYTIC REDUCTION OF OXCARBAZEPINE Portela & C.A. S.A (PT) 2008-04-30 EP disclosed
WO-2007012793-A1 ASYMMETRIC CATALYTIC REDUCTION OF OXCARBAZEPINE PORTELA & C.A., S.A. (PT) 2007-02-01 WO disclosed
WO-2005028437-A1 PROCESS FOR THE PREPARATION OF SECONDARY AMINOALCOHOLS AVECIA PHARMACEUTICALS LIMITED (GB) 2005-03-31 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 (4 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-20090203902-A1 Asymmetric catalytic reduction of oxcarbazepine HRH4, HRH3, HRH2 CA12 397/4885CA9 177/4885L3MBTL1 3324/4885
US-20160176823-A1 Asymmetric Catalytic Reduction of Oxcarbazepine HRH4, HRH3, HRH2 CA12 397/4885CA9 177/4885L3MBTL1 3324/4885
US-20170190668-A1 ASYMMETRIC CATALYTIC REDUCTION OF OXCARBAZEPINE HRH4, HRH3, HRH2 CA12 397/4885CA9 177/4885L3MBTL1 3324/4885
US-20090187028-A1 Process for preparing Chiral Dipeptidyl Peptidase -IV Inhibitor Intermediates DPP4, DPP3, DPP7 CA12 3061/4885CA9 678/4885L3MBTL1 4461/4885

“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.