SCHEMBL20416992

SCHEMBL20416992

N#Cc1cccc(-c2cc(-c3cn(Cc4cccc(OCC(O)O)c4)nn3)nc(N)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 14/20 0.45
▸ ADORA2B P29275 13/20 0.44
▸ CD74 P04233 1/20 0.42
▸ MIF P14174 1/20 0.42
▸ GPR55 Q9Y2T6 1/20 0.41
▸ KLKB1 P03952 1/20 0.41
▸ CYP19A1 P11511 1/20 0.40
▸ MAOB P27338 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
SCHEMBL20400183 0.87 ADORA2A (0.52) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL20436613 0.87 ADORA2A (0.47) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL29653564 0.85 ADORA2A (0.55) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL20416884 0.85 ADORA2A (0.55) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL20400756 0.85 ADORA2A (0.48) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL27029403 0.84 ADORA2A (0.47) ADORA2AADORA2BCD74MIFGPR55
SCHEMBL20436604 0.84 ADORA2A (0.51) ADORA2AADORA2BKLKB1CYP19A1
SCHEMBL20436595 0.84 ADORA2A (0.62) ADORA2AADORA2BCYP19A1
SCHEMBL20436606 0.82 ADORA2A (0.47) ADORA2AADORA2BKLKB1CYP19A1
SCHEMBL20436596 0.82 ADORA2A (0.54) ADORA2AADORA2BKLKB1CYP19A1

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
EP-4310082-A2 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS Arcus Biosciences, Inc. (US) 2024-01-24 — — EP disclosed
WO-2018136700-A1 AZOLOPYRIMIDINE FOR THE TREATMENT OF CANCER-RELATED DISORDERS ARCUS BIOSCIENCES, INC. (US) 2018-07-26 — — WO disclosed
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