SCHEMBL30401332

SCHEMBL30401332

N#Cc1cccc(-c2cc(-c3cn(Cc4ccccc4C(=O)O)nn3)nc(N)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 16/20 0.50
▸ ADORA2B P29275 13/20 0.48
▸ UCHL5 Q9Y5K5 2/20 0.46
▸ ADORA1 P30542 1/20 0.43
▸ CYP19A1 P11511 1/20 0.43

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
SCHEMBL20416965 1.00 ADORA2A (0.50) ADORA2AADORA2BUCHL5ADORA1CYP19A1
SCHEMBL30401819 0.90 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20400924 0.89 ADORA2A (0.50) ADORA2AADORA2BADORA1CYP19A1
SCHEMBL30401117 0.87 ADORA2A (0.52) ADORA2AADORA2B
SCHEMBL20417098 0.87 ADORA2A (0.52) ADORA2AADORA2B
SCHEMBL30400781 0.85 UCHL5 (0.55) ADORA2AADORA2BUCHL5ADORA1CYP19A1
SCHEMBL20400588 0.85 UCHL5 (0.55) ADORA2AADORA2BUCHL5ADORA1CYP19A1
SCHEMBL20436597 0.85 ADORA2A (0.55) ADORA2AADORA2B
SCHEMBL20436595 0.85 ADORA2A (0.62) ADORA2AADORA2BADORA1CYP19A1
SCHEMBL20400923 0.84 ADORA2A (0.48) ADORA2AADORA2B

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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