SCHEMBL3430220

SCHEMBL3430220

NC(c1ccccc1)S(N)(=O)=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.48
F2 P00734 1/20 0.48
CA1 P00915 6/20 0.44
CA2 P00918 6/20 0.44
CA9 Q16790 5/20 0.44
CA12 O43570 3/20 0.44
CA14 Q9ULX7 2/20 0.44
CA5A P35218 2/20 0.44
CA7 P43166 2/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
PLA2G7 Q13093 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
GBA1 P04062 1/20 0.41
SRC P12931 1/20 0.40

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
SCHEMBL15232676 0.82 DPP4 (0.50) DPP4F2CA1CA2CA9
SCHEMBL13096280 0.78 DPP4 (0.46) DPP4F2CA1CA2CA9
SCHEMBL6528197 0.78 DPP4 (0.46) DPP4F2GBA1SRC
SCHEMBL14642590 0.78 DPP4 (0.46) DPP4F2CA1CA2CA9
SCHEMBL332222 0.78 SRC (0.54) DPP4F2SRC
SCHEMBL2360079 0.78 DPP4 (0.46) DPP4F2GBA1SRC
SCHEMBL7695092 0.77 CA1 (0.46) DPP4F2CA1CA2CA9
SCHEMBL3637962 0.77 CYP2C19 (0.48) DPP4F2CA1CA2CA9
Hydrochloric Acid SCHEMBL3923326 0.76 DPP4 (0.44) DPP4F2GBA1
Hydrochloric Acid SCHEMBL4574710 0.76 DPP4 (0.44) DPP4F2GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022139386-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 주식회사 비투에스바이오 2022-06-30 WO claimed
EP-3186232-A1 P38 MAP KINASE INHIBITING INDANYL UREA COMPOUNDS Torrent Pharmaceuticals Limited (IN) 2017-07-05 EP claimed
WO-2016030852-A1 P38 MAP KINASE INHIBITING INDANYL UREA COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2016-03-03 WO claimed
EP-2748331-A1 SUSCEPTIBILITY TO SELECTIVE CDK9 INHIBITORS Lead Discovery Center GmbH (DE) 2014-07-02 EP claimed
WO-2013026890-A1 SUSCEPTIBILITY TO SELECTIVE CDK9 INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2013-02-28 WO claimed
WO-2022211573-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 테라펙스 2022-10-06 WO disclosed
US-20200331910-A1 Mammalian and Bacterial Nitric Oxide Synthase Inhibitors UNIV NORTHWESTERN (US) 2020-10-22 US disclosed
US-10759791-B2 Mammalian and bacterial nitric oxide synthase inhibitors NORTHWESTERN UNIVERSITY (US) 2020-09-01 US disclosed
US-20170275278-A1 Mammalian and Bacterial Nitric Oxide Synthase Inhibitors NORTHWESTERN UNIVERSITY (US) 2017-09-28 US disclosed
WO-2013130943-A1 ALKYL-AND DI-SUBSTITUTED AMIDO-BENZYL SULFONAMIDE DERIVATIVES GENENTECH, INC. (US) 2013-09-06 WO disclosed
WO-2013130943-A1 ALKYL-AND DI-SUBSTITUTED AMIDO-BENZYL SULFONAMIDE DERIVATIVES GENENTECH, INC. (US) 2013-09-06 WO disclosed
US-20130079345-A1 PHARMACEUTICALLY ACTIVE DISUBSTITUTED TRIAZINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-03-28 US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
EP-2252296-A1 3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES Wyeth LLC (US) 2010-11-24 EP disclosed
WO-2009091788-A1 3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-07-23 WO disclosed
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration HUTCHISON MEDIPHARMA ENTERPRISES LIMETED (BS) 2008-10-16 US disclosed
EP-0135927-B1 ANTIHYPERLIPIDEMIC N-BENZOYLSULFAMATES, N-BENZYLSULFAMATES AND BENZYLSULFONAMIDES, A THERAPEUTIC COMPOSITION CONTAINING SAME AND A PROCESS FOR THE PRODUCTION THEREOF Research Corporation (US) 1988-07-06 EP disclosed
EP-0204244-A2 Tetrakis azo dyes BAYER AG (DE) 1986-12-10 EP disclosed
EP-0135927-A2 Antihyperlipidemic N-benzoylsulfamates, N-benzylsulfamates and benzylsulfonamides, a therapeutic composition containing same and a process for the production thereof Research Corporation (US) 1985-04-03 EP disclosed
US-4499303-A Antihyperlipidemic N-benzoylsulfamates, N-benzylsulfamates and benzylsulfonamides RESEARCH CORPORATION (US) 1985-02-12 US 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 (5 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-20200331910-A1 Mammalian and Bacterial Nitric Oxide Synthase Inhibitors NOS1, NOS2, NOS3 DPP4 2246/4885F2 2927/4885CA1 2182/4885
US-20130079345-A1 PHARMACEUTICALLY ACTIVE DISUBSTITUTED TRIAZINE DERIVATIVES PDE5A, TESK2, PAK5 DPP4 378/4885F2 3283/4885CA1 4406/4885
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration CCND2, KDR, FLT4 DPP4 753/4885F2 240/4885CA1 4855/4885
US-20170275278-A1 Mammalian and Bacterial Nitric Oxide Synthase Inhibitors NOS1, NOS2, NOS3 DPP4 2246/4885F2 2927/4885CA1 2182/4885
US-10759791-B2 Mammalian and bacterial nitric oxide synthase inhibitors NOS1, NOS2, NOS3 DPP4 2246/4885F2 2927/4885CA1 2182/4885

“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.