SCHEMBL5507265

SCHEMBL5507265

CCCn1c(=O)c2[nH]c(-c3c[nH]nc3Cc3nc(-c4ccc(Cl)cc4)no3)nc2n(CC)c1=O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.67
ADORA1 P30542 14/20 0.67
ADORA3 P0DMS8 9/20 0.67
ADORA2A P29274 7/20 0.67

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
SCHEMBL5507269 0.85 ADORA2B (0.68) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL239323 0.80 ADORA2B (1.00) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL1948072 0.79 ADORA2B (1.00) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL240285 0.78 ADORA2B (1.00) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4176128 0.75 ADORA2B (0.62) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL3466506 0.74 ADORA2B (0.59) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL3466575 0.74 ADORA2B (0.61) ADORA2BADORA1ADORA2A
SCHEMBL5685513 0.73 ADORA2B (0.59) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL1943830 0.73 ADORA2B (0.55) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4291542 0.73 ADORA2B (0.66) ADORA2BADORA1ADORA3ADORA2A

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-1789053-A2 METHOD OF WOUND HEALING USING A2B ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2007-05-30 EP claimed
WO-2006028810-A2 METHOD OF WOUND HEALING USING A2B ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2006-03-16 WO claimed