SCHEMBL4941409

SCHEMBL4941409

Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.77
CA1 P00915 3/20 0.77
CA9 Q16790 2/20 0.71
CA12 O43570 1/20 0.71
HTT P42858 2/20 0.65
KMT2A Q03164 4/20 0.64
MEN1 O00255 3/20 0.64
ALDH1A1 P00352 3/20 0.64
CYP3A4 P08684 2/20 0.64
KDM4E B2RXH2 1/20 0.64
HPGD P15428 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
FFAR4 Q5NUL3 1/20 0.62
KEAP1 Q14145 1/20 0.62
MAPT P10636 3/20 0.60
LMNA P02545 1/20 0.60
MAPK1 P28482 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
PRMT1 Q99873 1/20 0.58
CYP1A2 P05177 1/20 0.58

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
SCHEMBL20472197 1.00 CA2 (0.77) CA2CA1CA9CA12HTT
SCHEMBL7498033 0.91 CA2 (0.83) CA2CA1CA9CA12HTT
SCHEMBL540915 0.86 CA1 (0.85) CA2CA1CA9CA12HTT
SCHEMBL11793140 0.86 CA1 (0.85) CA2CA1CA9CA12HTT
SCHEMBL4823249 0.85 CA2 (0.90) CA2CA1CA9CA12HTT
SCHEMBL5230151 0.83 CES1 (0.73) CA2CA1CA9CA12HTT
SCHEMBL98037 0.83 CA2 (0.71) CA2CA1CA9CA12HTT
SCHEMBL4574130 0.83 CA2 (0.71) CA2CA1CA9CA12HTT
SCHEMBL21247922 0.83 CA2 (0.71) CA2CA1CA9CA12HTT
SCHEMBL6577363 0.83 CA2 (0.71) CA2CA1CA9CA12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186049-A 2, 2-dimethyl-2H chromene derivative containing sulfonamide unit, and preparation method and application thereof 贵州大学 2023-12-08 CN disclosed
EP-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed
US-7074789-B2 Kinase inhibitors AMGEN INC. (US) 2006-07-11 US disclosed
US-6881737-B2 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. (US) 2005-04-19 US disclosed
US-20040116388-A1 triazine compoound inhibitors of enzymes that catalyze phosphoryl transfer and/or that bind ATP/GTP nucleotides AMGEN INC. 2004-06-17 US disclosed
EP-1390354-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS Amgen Inc. (US) 2004-02-25 EP disclosed
US-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. 2003-07-24 US disclosed
WO-2002083653-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS AMGEN INC. (US) 2002-10-24 WO disclosed
EP-1218360-A1 TRIAZINE KINASE INHIBITORS Amgen Inc., (US) 2002-07-03 EP disclosed
WO-2001025220-A1 TRIAZINE KINASE INHIBITORS AMGEN INC. (US) 2001-04-12 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 (1 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-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use PKD1, PKD2, GLS CA2 1558/4885CA1 2390/4885CA9 1102/4885

“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.