SCHEMBL13183841

SCHEMBL13183841

CCCn1[nH]c2nc(-c3cnn(CC#Cc4ccc(F)cc4)c3)[nH]c2c1=O

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 20/20 0.77

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
SCHEMBL1063427 0.87 ADORA2B (1.00) ADORA2B
SCHEMBL1064296 0.82 ADORA2B (1.00) ADORA2B
SCHEMBL4405247 0.80 ADORA2B (1.00) ADORA2B
SCHEMBL1063293 0.79 ADORA2B (0.76) ADORA2B
SCHEMBL1067264 0.79 ADORA2B (0.85) ADORA2B
SCHEMBL1067544 0.78 ADORA2B (1.00) ADORA2B
SCHEMBL1064797 0.77 ADORA2B (1.00) ADORA2B
SCHEMBL1724681 0.77 ADORA2B (0.69) ADORA2B
SCHEMBL21121464 0.77 ADORA2B (0.77) ADORA2B
SCHEMBL1064332 0.76 ADORA2B (1.00) ADORA2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 — — WO disclosed
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