Sugi Predict

Sugi Predict / Compounds / SCHEMBL2597446

SCHEMBL2597446

SCHEMBL2597446

CC(C)c1cc2[nH]c(=O)n(N(C(=O)CCCOCc3ccccc3)S(C)(=O)=O)c(=O)c2cc1-c1ccnn1C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.37
▸ TP53 P04637 1/20 0.34
▸ HPGD P15428 4/20 0.33
▸ GAA P10253 1/20 0.33
▸ HSD17B10 Q99714 6/20 0.32
▸ ALDH1A1 P00352 6/20 0.32
▸ POLB P06746 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ KMT2A Q03164 2/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30
▸ IMPDH2 P12268 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ FNTA P49354 1/20 0.30
▸ FNTB P49356 1/20 0.30

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
SCHEMBL2597335 0.87 KDM4E (0.35) KDM4EHPGDGAAHSD17B10ALDH1A1
SCHEMBL2597264 0.86 KDM4E (0.37) KDM4EHPGDGAAHSD17B10ALDH1A1
SCHEMBL2597238 0.81 HAVCR2 (0.32) KDM4EHSD17B10ALDH1A1POLBIMPDH2
SCHEMBL2597409 0.81 HAVCR2 (0.32) IMPDH2
SCHEMBL2597358 0.80 IMPDH2 (0.36) KDM4EHPGDGAAHSD17B10ALDH1A1
SCHEMBL2597208 0.79 KDM4E (0.34) KDM4EHPGDGAAHSD17B10ALDH1A1
SCHEMBL2597239 0.76 KDM4E (0.36) KDM4ETP53HPGDGAAHSD17B10
SCHEMBL2597135 0.75 HAVCR2 (0.32) KDM4EHPGDGAAHSD17B10ALDH1A1
SCHEMBL2597069 0.73 CYP1A2 (0.34) —
SCHEMBL12180538 0.70 ALDH1A1 (0.33) HPGDALDH1A1POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571865-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES Novartis AG (CH) 2013-03-27 — — EP claimed
US-20130053381-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG 2013-02-28 — — US claimed
WO-2011144666-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2011-11-24 — — WO claimed
EP-2571865-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES Novartis AG (CH) 2013-03-27 — — EP disclosed
US-20130053381-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG 2013-02-28 — — US disclosed
US-20130053381-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG 2013-02-28 — — US disclosed
US-20130053381-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG 2013-02-28 — — US disclosed
WO-2011144666-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2011-11-24 — — WO disclosed
WO-2011144666-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2011-11-24 — — 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-20130053381-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES GRIK2, GRIK1, GRIK4 KDM4E 784/4885TP53 3888/4885HPGD 1428/4885

“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.