SCHEMBL4714360

SCHEMBL4714360

CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCCN(Cc5ccc(F)cc5)CC4)cc3)cc21

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.79
ADORA1 P30542 12/20 0.72
ADORA3 P0DMS8 11/20 0.72
ADORA2A P29274 4/20 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
SCHEMBL4057142 0.97 ADORA2B (0.84) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4058115 0.94 ADORA2B (0.78) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4059415 0.92 ADORA2B (0.79) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4059142 0.91 ADORA2B (0.93) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4051717 0.91 ADORA2B (0.75) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4055762 0.90 ADORA2B (0.82) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4051557 0.90 ADORA2B (0.77) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4058193 0.89 ADORA2B (0.82) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4053967 0.89 ADORA2B (0.83) ADORA2BADORA1ADORA3ADORA2A
SCHEMBL4057526 0.88 ADORA2B (0.75) 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 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