SCHEMBL2953631

SCHEMBL2953631

N#Cc1ccccc1-c1cc(-c2ccccn2)cn(-c2ccoc2)c1=O

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.77
GRIA3 P42263 1/20 0.77
PDE4D Q08499 1/20 0.77
GRM5 P41594 4/20 0.36
GABRA1 P14867 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA5 P31644 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
AR P10275 1/20 0.32

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
Perampanel SCHEMBL194370 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL29718723 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL4214584 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL31069847 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL29354621 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL2857277 0.87 GRIA1 (1.00) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL2866904 0.86 GRIA1 (0.98) GRIA1GRIA3PDE4DGRM5GABRA1
Perampanel SCHEMBL29363161 0.86 GRIA1 (0.98) GRIA1GRIA3PDE4DGRM5GABRA1
SCHEMBL1881690 0.85 PDE4D (0.87) GRIA1GRIA3PDE4DGRM5GABRA1
SCHEMBL1880403 0.84 GRIA1 (0.85) GRIA1GRIA3PDE4DGRM5GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759367-B2 1,2-dihydropiridin-2-one compounds such as 3-(2-cyanophenyl)-1-phenyl-5-(2-pyridyl)-1,2-dihydropyridin-2-one, used as immunomodulators or antiinflammatory agents, and for the prevention or treatment of neurodegenerative diseases, such as demyelinating disorders EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-07-20 US disclosed
EP-1300396-B1 1,2-DIHYDROPYRIDINE COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME AND USE THEREOF EISAI R&D MAN CO LTD (JP) 2009-01-14 EP disclosed
EP-1465626-B1 PHARMACEUTICAL COMPOSITIONS (KIT) COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY (OR AN ANTIINFLAMMATORY) AGENT AND THEIR USES EISAI R&D MAN CO LTD (JP) 2008-09-03 EP disclosed
US-20060100249-A1 Pharmaceutical compositions comprising dihydropyridinone compounds and an immunoregulatory or an antiinflammatory agent and their uses EISAI R & D MANAGEMENT CO., LTD. (JP) 2006-05-11 US disclosed
EP-1465626-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY OR AN ANTIINFLAMMATORY AGENT AND THEIR USES Eisai Co., Ltd. (JP) 2004-10-13 EP disclosed
WO-2003047577-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY OR AN ANTIINFLAMMATORY AGENT AND THEIR USES EISAI CO LTD (JP) 2003-06-12 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-20060100249-A1 Pharmaceutical compositions comprising dihydropyridinone compounds and an immunoregulatory or an antiinflammatory agent and their uses QDPR, PMP22, MAG GRIA1 449/4885GRIA3 663/4885PDE4D 679/4885

“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.