SCHEMBL30402302

SCHEMBL30402302

N#Cc1cccc(-c2cc(-c3cn(Cc4ccc(C(=O)O)cn4)nn3)nc(N)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 15/20 0.46
▸ ADORA1 P30542 3/20 0.43
▸ ADORA2B P29275 11/20 0.43
▸ UCHL5 Q9Y5K5 2/20 0.42
▸ UCHL1 P09936 1/20 0.42
▸ UCHL3 P15374 1/20 0.42
▸ PDE4A P27815 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ CDC7 O00311 1/20 0.40
▸ DAPK3 O43293 1/20 0.40
▸ ROCK2 O75116 1/20 0.40
▸ PAK4 O96013 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ FLT3 P36888 1/20 0.40
▸ CSNK1A1 P48729 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ CLK2 P49760 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ CDK7 P50613 1/20 0.40

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
SCHEMBL20401237 1.00 ADORA2A (0.46) ADORA2AADORA1ADORA2BUCHL5UCHL1
SCHEMBL20436457 0.93 ADORA2A (0.45) ADORA2AADORA1ADORA2B
SCHEMBL20400874 0.90 ADORA2A (0.52) ADORA2AADORA1ADORA2B
SCHEMBL20401627 0.88 ADORA2A (0.47) ADORA2AADORA1ADORA2BUCHL5UCHL1
SCHEMBL20436717 0.86 ADORA2A (0.51) ADORA2AADORA1ADORA2B
SCHEMBL20400588 0.85 UCHL5 (0.55) ADORA2AADORA1ADORA2BUCHL5UCHL1
SCHEMBL30400781 0.85 UCHL5 (0.55) ADORA2AADORA1ADORA2BUCHL5UCHL1
SCHEMBL20416872 0.85 ADORA2A (0.49) ADORA2AADORA1ADORA2B
SCHEMBL30401864 0.83 ADORA2A (0.55) ADORA2AADORA1ADORA2B
SCHEMBL20400722 0.83 ADORA2A (0.55) 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-116768859-A Azolopyrimidines for the treatment of cancer related disorders 艾库斯生物科学有限公司 2023-09-19 — — CN disclosed
CN-110214012-B Azolopyrimidines for the treatment of cancer related disorders 艾库斯生物科学有限公司 2023-05-09 — — CN disclosed
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