SCHEMBL1661007

SCHEMBL1661007

CC(F)c1cc2[nH]c(=O)n(NS(C)(=O)=O)c(=O)c2cc1-c1ccnn1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 3/20 0.35
HAVCR2 Q8TDQ0 1/20 0.33
PARG Q86W56 1/20 0.33
CYP1A2 P05177 1/20 0.32
METAP2 P50579 1/20 0.32
BRD4 O60885 1/20 0.31
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 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
SCHEMBL1661254 0.93 HAVCR2 (0.34) IDH1HAVCR2PARGCYP1A2METAP2
Selurampanel SCHEMBL1660562 0.92 HAVCR2 (0.34) IDH1HAVCR2CYP1A2METAP2BRD4
Selurampanel SCHEMBL30259242 0.92 HAVCR2 (0.34) IDH1HAVCR2CYP1A2METAP2BRD4
SCHEMBL1660532 0.90 IDH1 (0.33) IDH1HAVCR2PARG
SCHEMBL1661230 0.84 CYP1A2 (0.39) HAVCR2CYP1A2METAP2BRD4
SCHEMBL1661015 0.84 IDH1 (0.33) IDH1HAVCR2
SCHEMBL1001057 0.83 CYP1A2 (0.36) IDH1HAVCR2PARGCYP1A2METAP2
SCHEMBL1661264 0.83 HAVCR2 (0.34) IDH1HAVCR2PARGCYP1A2METAP2
SCHEMBL1663156 0.83 HAVCR2 (0.35) HAVCR2PARGCYP1A2METAP2BRD4
SCHEMBL4628060 0.82 HAVCR2 (0.33) HAVCR2CYP1A2METAP2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163050-A1 Use of 1H-quinazoline-2,4-diones JOHNS DONALD (US) 2014-06-12 US claimed
US-20140018376-A1 Use of 1H-Quinazoline-2,4-Diones ALLGEIER HANS (DE) 2014-01-16 US claimed
EP-2585070-A1 USE OF 1H-QUINAZOLINE-2,4-DIONES Novartis AG (CH) 2013-05-01 EP claimed
US-20130096145-A1 Use of 1H-quinazoline-2,4-diones NOVARTIS AG (CH) 2013-04-18 US claimed
US-20130090346-A1 Use of 1H-quinazoline-2,4-diones NOVARTIS AG (CH) 2013-04-11 US claimed
WO-2013036224-A1 USE OF 1H-QUINAZOLINE- 2, 4 -DIONES FOR USE IN THE PREVENTION OR TREATMENT PHOTOSENSITIVE EPILEPSY NOVARTIS AG (CH) 2013-03-14 WO claimed
EP-2490691-A1 USE OF 1H-QUINAZOLINE-2,4-DIONES Novartis AG (CH) 2012-08-29 EP claimed
US-20120122903-A1 1-H-QUINAZOLINE-2, 4-DIONES FOR USE IN THE TREATMENT OF NEURONAL CEROID LIPOFUSCINOSIS NOVARTIS AG (CH) 2012-05-17 US claimed
WO-2011161249-A1 USE OF 1H-QUINAZOLINE-2,4-DIONES NOVARTIS AG (CH) 2011-12-29 WO claimed
WO-2011048150-A1 USE OF 1H-QUINAZOLINE-2,4-DIONES NOVARTIS AG (CH) 2011-04-28 WO claimed
US-20140163050-A1 Use of 1H-quinazoline-2,4-diones JOHNS DONALD (US) 2014-06-12 US disclosed
US-20140163050-A1 Use of 1H-quinazoline-2,4-diones JOHNS DONALD (US) 2014-06-12 US disclosed
US-20140018376-A1 Use of 1H-Quinazoline-2,4-Diones ALLGEIER HANS (DE) 2014-01-16 US disclosed
US-20140018376-A1 Use of 1H-Quinazoline-2,4-Diones ALLGEIER HANS (DE) 2014-01-16 US disclosed
US-20130296332-A1 1H-QUINAZOLINE-2,4-DIONES NOVARTIS AG (CH) 2013-11-07 US disclosed
US-7655666-B2 Substituted 1H-quinazoline-2,4-diones useful as AMPA receptor ligands NOVARTIS AG (CH) 2010-02-02 US disclosed
US-7655666-B2 Substituted 1H-quinazoline-2,4-diones useful as AMPA receptor ligands NOVARTIS AG (CH) 2010-02-02 US disclosed
US-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders NOVARTIS AG (CH) 2008-06-26 US disclosed
US-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders NOVARTIS AG (CH) 2008-06-26 US disclosed
US-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders NOVARTIS AG (CH) 2008-06-26 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 (7 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-20130090346-A1 Use of 1H-quinazoline-2,4-diones GRIK2, GRIK1, GRIK4 IDH1 2214/4885HAVCR2 1866/4885PARG 4131/4885
US-20130096145-A1 Use of 1H-quinazoline-2,4-diones GRM1, GRIK2, GRIK1 IDH1 2399/4885HAVCR2 3857/4885PARG 4311/4885
US-20140018376-A1 Use of 1H-Quinazoline-2,4-Diones GRIK1, GRIK2, GRIK4 IDH1 1254/4885HAVCR2 751/4885PARG 4823/4885
US-20140163050-A1 Use of 1H-quinazoline-2,4-diones GRIK2, GRIK1, GRIK4 IDH1 2214/4885HAVCR2 1866/4885PARG 4131/4885
US-20120122903-A1 1-H-QUINAZOLINE-2, 4-DIONES FOR USE IN THE TREATMENT OF NEURONAL CEROID LIPOFUSCINOSIS CLN6, GBA1, GBA2 IDH1 2878/4885HAVCR2 3421/4885PARG 4276/4885
US-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders GRIN2A, GRIN1, GRIN2D IDH1 719/4885HAVCR2 4615/4885PARG 2966/4885
US-20130296332-A1 1H-QUINAZOLINE-2,4-DIONES CYP1A2, QDPR, CYP3A7 IDH1 277/4885HAVCR2 4669/4885PARG 2668/4885

“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.