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SCHEMBL29907672

SCHEMBL29907672

Cn1cc(-c2nc(C(N)=O)cnc2-c2ncco2)ccc1=O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 18/20 0.51
▸ ADORA1 P30542 12/20 0.51
▸ ADORA2B P29275 6/20 0.51
▸ BRD4 O60885 1/20 0.40
▸ DYRK1A Q13627 1/20 0.39

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
SCHEMBL29907714 0.90 ADORA2A (0.51) ADORA2AADORA1ADORA2BBRD4DYRK1A
SCHEMBL29907690 0.87 ADORA2A (0.49) ADORA2AADORA1ADORA2BBRD4DYRK1A
SCHEMBL29907725 0.85 ADORA2A (0.54) ADORA2AADORA1ADORA2B
SCHEMBL29907696 0.84 ADORA2A (0.46) ADORA2AADORA1ADORA2B
SCHEMBL29907536 0.84 ADORA2A (0.49) ADORA2AADORA1ADORA2B
SCHEMBL29907604 0.80 ADORA2A (0.61) ADORA2AADORA1ADORA2B
SCHEMBL29907659 0.80 ADORA2A (0.56) ADORA2AADORA1ADORA2BBRD4
SCHEMBL29907760 0.79 IRAK4 (0.36) ADORA2AADORA1ADORA2B
SCHEMBL29907757 0.78 ADORA2A (0.48) ADORA2AADORA1ADORA2BBRD4DYRK1A
SCHEMBL21730185 0.77 ADORA2A (0.66) ADORA2AADORA1ADORA2B

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-115181092-A Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2022-10-14 — — CN disclosed
CN-112279837-B Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2022-08-09 — — CN disclosed