SCHEMBL4716699

SCHEMBL4716699

CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccc(OC)c(OC)c5)CC4)cc3)cc2n(C)c1=O

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.70
ADORA3 P0DMS8 10/20 0.70
ADORA1 P30542 10/20 0.70
ADORA2A P29274 5/20 0.51

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
SCHEMBL4054313 0.95 ADORA2B (0.78) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4050917 0.94 ADORA2B (0.70) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4055274 0.92 ADORA2B (0.77) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4062799 0.89 ADORA2B (0.78) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4051648 0.88 ADORA2B (0.79) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4237457 0.88 ADORA2B (0.89) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL6158129 0.83 ADORA2B (0.85) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4051706 0.83 ADORA2B (1.00) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4053554 0.82 ADORA2B (0.70) ADORA2BADORA3ADORA1ADORA2A
SCHEMBL4235347 0.82 ADORA2B (0.79) ADORA2BADORA3ADORA1ADORA2A

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
EP-1492793-B1 NEW-4-(PYRROLOPYRIMIDIN-6-YL)BENZENESULPHONAMIDE DERIVATIVES ALMIRALL LAB (ES) 2008-01-16 EP disclosed