SCHEMBL7440463

SCHEMBL7440463

CCCn1cnc2c(=O)[nH]c(-c3cc(S(=O)(=O)Cl)ccc3OCC)nc21

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.75
PDE1A P54750 3/20 0.69
PDE1B Q01064 3/20 0.69
PDE1C Q14123 3/20 0.69
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL9021978 0.86 PDE5A (1.00) PDE5APDE1APDE1BPDE1C
SCHEMBL9021637 0.85 PDE5A (0.86) PDE5APDE1APDE1BPDE1C
SCHEMBL3012296 0.83 PDE5A (0.55) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL3023422 0.83 PDE5A (0.54) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL7446406 0.82 PDE1A (1.00) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL7355633 0.80 PDE5A (0.53) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL7025694 0.79 PDE5A (0.50) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL3030666 0.77 PDE5A (0.55) PDE5A
SCHEMBL3023652 0.77 PDE5A (0.55) PDE5APDE1APDE1BPDE1C
SCHEMBL3023136 0.77 PDE5A (0.51) PDE5APDE1APDE1BPDE1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5734053-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS PFIZER INC (US) 1998-03-31 US disclosed
EP-0647227-B1 PURINONE ANTIANGINAL AGENTS PFIZER LTD (GB) 1996-10-09 EP disclosed
EP-0647227-A1 PURINONE ANTIANGINAL AGENTS. PFIZER LTD (GB) 1995-04-12 EP disclosed
WO-1994000453-A1 PURINONE ANTIANGINAL AGENTS PFIZER LIMITED (GB) 1994-01-06 WO disclosed