SCHEMBL30399745

SCHEMBL30399745

Cc1cccc(Cn2cc(-c3cc(-c4cccc(C#N)c4)nc(N)n3)nn2)n1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 17/20 0.54
▸ ADORA2B P29275 16/20 0.54
▸ ADORA1 P30542 1/20 0.54

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
SCHEMBL20400704 1.00 ADORA2A (0.54) ADORA2AADORA2BADORA1
SCHEMBL20416666 0.90 ADORA2A (0.54) ADORA2AADORA2BADORA1
SCHEMBL30401511 0.90 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20400627 0.90 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20442170 0.89 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20436440 0.89 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20442138 0.89 ADORA2A (0.49) ADORA2AADORA2BADORA1
SCHEMBL20416807 0.89 CTSS (0.51) ADORA2AADORA2BADORA1
SCHEMBL30402137 0.88 ADORA2A (0.51) ADORA2AADORA2BADORA1
SCHEMBL20400687 0.88 ADORA2A (0.51) ADORA2AADORA2BADORA1

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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