SCHEMBL27580466

SCHEMBL27580466

N#Cc1ccccc1N1N=C(c2ccccn2)CN(c2cccc(N)c2)C1C=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRKCZ Q05513 1/20 0.35
▸ GRIA1 P42261 1/20 0.34
▸ GRIA3 P42263 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ GRM5 P41594 13/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ UCHL1 P09936 1/20 0.31
▸ DHFR P00374 1/20 0.31

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
SCHEMBL27771612 0.90 GRIA1 (0.38) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27755572 0.88 NPSR1 (0.39) PRKCZGRIA1GRIA3PDE4DALDH1A1
SCHEMBL27598121 0.86 PIK3CD (0.37) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27755573 0.85 GRM5 (0.33) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27735035 0.84 GRIA1 (0.38) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27755568 0.84 GRM5 (0.34) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27735021 0.83 ALDH1A1 (0.33) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27734999 0.82 PRKCZ (0.34) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27755571 0.80 GRM5 (0.33) PRKCZGRIA1GRIA3PDE4DGRM5
SCHEMBL27861662 0.79 GRM5 (0.37) GRIA1GRIA3PDE4DGRM5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101486683-A Pyridazinone and triazinone compounds and their use as pharmaceutical formulations EISAI R&D MAN CO LTD (JP) 2009-07-22 — — CN disclosed
CN-1458924-A Pyridazinone and triazinone compounds and their use as pharmaceutical formulations EISAI CO LTD (JP) 2003-11-26 — — CN disclosed
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