SCHEMBL27735008

SCHEMBL27735008

O=CC1N(c2cccnc2)CC(c2ccccn2)=NN1c1ccccc1Br

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 1/20 0.34
▸ PRKCZ Q05513 1/20 0.33
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ BRAF P15056 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
SCHEMBL27755569 0.91 PRKCZ (0.36) PRKCZMAPT
SCHEMBL27735006 0.88 CYP2A6 (0.39) CYP2A6PRKCZMAPTMAPK1HTT
SCHEMBL27735000 0.87 PRKCZ (0.34) PRKCZ
SCHEMBL27755573 0.87 GRM5 (0.33) CYP2A6PRKCZBRAF
SCHEMBL27755562 0.85 FLT3 (0.34) PRKCZMAPTMAPK1HTTNPC1
SCHEMBL27735005 0.85 MEN1 (0.34) PRKCZ
SCHEMBL27735007 0.85 SMN1; SMN2 (0.36) PRKCZMAPT
SCHEMBL27755589 0.83 PRKCZ (0.31) PRKCZ
SCHEMBL27598051 0.83 NPSR1 (0.40) PRKCZMAPTNPC1RAB9A
SCHEMBL27735037 0.83 PRKCZ (0.35) PRKCZHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101486683-B Pyridazinone and triazinone compounds and their use as pharmaceutical formulations Sanitary Material R&D Management Co.,Ltd. (JP) 2011-12-21 — — CN disclosed
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-100473647-C Pyridazinone and triazinone compounds and their use as pharmaceutical formulations EISAI CO LTD (JP) 2009-04-01 — — CN disclosed
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