SCHEMBL7342467

SCHEMBL7342467

Nc1nc2nn(Cc3ccc(O)cc3)cc2c2nc(-c3ccco3)nn12

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 15/20 0.72
ADORA3 P0DMS8 15/20 0.72
ADORA2B P29275 11/20 0.72
ADORA1 P30542 11/20 0.72
CSNK1A1 P48729 1/20 0.59
CSNK1D P48730 1/20 0.59

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
SCHEMBL7347236 0.91 ADORA3 (0.83) ADORA2AADORA3ADORA2BADORA1
SCHEMBL1755132 0.91 ADORA2A (0.74) ADORA2AADORA3ADORA2BADORA1
SCHEMBL8124426 0.89 ADORA2A (0.84) ADORA2AADORA3ADORA2BADORA1
SCHEMBL4759566 0.84 ADORA3 (1.00) ADORA2AADORA3ADORA2BADORA1
SCHEMBL7339258 0.82 ADORA3 (0.76) ADORA2AADORA3ADORA2BADORA1
SCHEMBL4759841 0.82 ADORA3 (1.00) ADORA2AADORA3ADORA2BADORA1
SCHEMBL4759270 0.81 ADORA3 (1.00) ADORA2AADORA3ADORA2BADORA1
SCHEMBL7345177 0.80 ADORA2A (1.00) ADORA2AADORA3ADORA2BADORA1
SCHEMBL4758498 0.80 ADORA3 (1.00) ADORA2AADORA3ADORA2BADORA1
SCHEMBL4824435 0.80 ADORA3 (1.00) ADORA2AADORA3ADORA2BADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0856003-B1 1,2,4-TRIAZOLO 1,5-c]PYRIMIDINE HETEROCYCLIC ANALOGUES HAVING ANTAGONISTIC ACTIVITY ON ADENOSINE A 2a? RECEPTOR SCHERING CORP (US) 2000-12-27 EP claimed
WO-1997005138-A1 1,2,4-TRIAZOLO[1,5-c]PYRIMIDINE HETEROCYCLIC ANALOGUES HAVING ANTAGONISTIC ACTIVITY ON ADENOSINE A2a RECEPTOR SCHERING-PLOUGH S.P.A. (IT) 1997-02-13 WO claimed
EP-0856003-B1 1,2,4-TRIAZOLO 1,5-c]PYRIMIDINE HETEROCYCLIC ANALOGUES HAVING ANTAGONISTIC ACTIVITY ON ADENOSINE A 2a? RECEPTOR SCHERING CORP (US) 2000-12-27 EP disclosed
US-5935964-A 1,2,4-triazolo 1,5-c! pyrimidine heterocyclic analogues having antagonistic activity on adenosine A2a receptor SCHERING CORPORATION (US) 1999-08-10 US disclosed
WO-1997005138-A1 1,2,4-TRIAZOLO[1,5-c]PYRIMIDINE HETEROCYCLIC ANALOGUES HAVING ANTAGONISTIC ACTIVITY ON ADENOSINE A2a RECEPTOR SCHERING-PLOUGH S.P.A. (IT) 1997-02-13 WO disclosed