SCHEMBL5261815

SCHEMBL5261815

CCCOc1ccc(S(=O)(=O)Cl)cc1-c1[nH]c2c(c1Cl)n(CCC)c(=O)n1cnnc21

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.40
ADORA2A P29274 2/20 0.36
ADORA2B P29275 1/20 0.36
ADORA3 P0DMS8 1/20 0.34
ADORA1 P30542 1/20 0.34

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
SCHEMBL5260943 0.94 PDE5A (0.41) PDE5AADORA2AADORA2B
SCHEMBL5264617 0.92 PDE5A (0.40) PDE5AADORA2AADORA2B
SCHEMBL5830512 0.91 PDE5A (0.43) PDE5AADORA2AADORA2BADORA3ADORA1
SCHEMBL5260459 0.91 PDE5A (0.39) PDE5A
SCHEMBL5259471 0.89 PDE5A (0.54) PDE5A
SCHEMBL5830413 0.89 PDE5A (0.52) PDE5AADORA2AADORA2B
SCHEMBL5265562 0.88 PDE5A (0.48) PDE5A
SCHEMBL5261002 0.88 CA12 (0.40) PDE5AADORA2B
SCHEMBL5830712 0.88 PDE5A (0.46) PDE5A
SCHEMBL5261074 0.88 PDE5A (0.36) PDE5A

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-1307458-B1 PYRROLOTRIAZOLOPYRIMIDINONE DERIVATIVES ALMIRALL LAB (ES) 2007-10-03 EP disclosed