SCHEMBL6629425

SCHEMBL6629425

CCCOc1ccc(S(C)(=O)=O)cc1-c1nc2c(CC)nn(C[C@@H]3CCCN3C)c2c(=O)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.62
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
PDE6C P51160 1/20 0.49
PDE11A Q9HCR9 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
SCHEMBL6630863 0.98 PDE5A (0.60) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6628210 0.94 PDE5A (0.62) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6810537 0.92 PDE5A (0.60) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6629280 0.91 PDE5A (0.52) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6811344 0.88 PDE5A (0.50) PDE5A
SCHEMBL6801989 0.84 PDE5A (0.53) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6811479 0.84 PDE5A (0.53) PDE5APDE6CPDE11A
SCHEMBL6802059 0.83 PDE5A (0.52) PDE5APDE3BPDE3APDE6CPDE11A
SCHEMBL6630217 0.81 POLB (0.51) PDE5APDE6CPDE11A
SCHEMBL6631741 0.79 PDE5A (0.49) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368352-B1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LTD (GB) 2004-12-01 EP claimed
US-6770645-B2 SEXUAL DISORDERS THERAPY; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2004-08-03 US claimed
US-20030064990-A1 Pharmaceutically active compounds PFIZER INC. 2003-04-03 US claimed
EP-1368352-B1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LTD (GB) 2004-12-01 EP disclosed
US-6770645-B2 SEXUAL DISORDERS THERAPY; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2004-08-03 US disclosed
EP-1368352-A1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS Pfizer Limited (GB) 2003-12-10 EP disclosed
US-20030064990-A1 Pharmaceutically active compounds PFIZER INC. 2003-04-03 US disclosed
WO-2002074774-A1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LIMITED (GB) 2002-09-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030064990-A1 Pharmaceutically active compounds PDE5A, PDE3A, PDE2A PDE5A 1/4885PDE3B 4/4885PDE3A 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.