SCHEMBL6407235

SCHEMBL6407235

COc1ccc(-c2cnc(N3CCc4c([nH]c5ccccc45)C3c3ccc(OC)c(OC)c3)nc2)cc1OC

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.83
ABCB1 P08183 1/20 0.57
ABCG2 Q9UNQ0 1/20 0.57
EGFR P00533 1/20 0.53
PDE6C P51160 2/20 0.51
PDE11A Q9HCR9 2/20 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
SCHEMBL6290660 0.91 PDE5A (1.00) PDE5A
SCHEMBL6407260 0.91 PDE5A (1.00) PDE5A
SCHEMBL6409670 0.91 PDE5A (1.00) PDE5A
SCHEMBL28392937 0.84 PDE5A (1.00) PDE5APDE6CPDE11A
SCHEMBL28395133 0.84 PDE5A (0.78) PDE5APDE6CPDE11A
SCHEMBL6413069 0.81 PDE5A (1.00) PDE5A
SCHEMBL6406398 0.81 PDE5A (1.00) PDE5A
SCHEMBL6406296 0.78 PDE5A (1.00) PDE5A
SCHEMBL6407670 0.78 PDE5A (1.00) PDE5A
SCHEMBL6409674 0.78 PDE5A (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050113402-A1 Substituted pyrrolopyridinone derivatives useful as phosphodiesterase inhibitors SUI ZHIHUA (US) 2005-05-26 US disclosed
EP-1296981-B1 SUBSTITUTED PYRROLOPYRIDINONE DERIVATIVES USEFUL AS PHOSPHODIESTERASE INHIBITORS ORTHO MCNEIL PHARM INC (US) 2004-10-06 EP disclosed
US-20020072055-A1 Iterative and regenerative DNA sequencing method THE UNIVERSITY OF IOWA RESEARCH FOUNDATION 2002-06-13 US disclosed
US-20020010183-A1 Substituted pyrrolopyridinone derivatives useful as phosphodiesterase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. 2002-01-24 US 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 (2 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-20050113402-A1 Substituted pyrrolopyridinone derivatives useful as phosphodiesterase inhibitors PDE5A, PDE3A, PDE3B PDE5A 1/4885ABCB1 1507/4885ABCG2 2481/4885
US-20020010183-A1 Substituted pyrrolopyridinone derivatives useful as phosphodiesterase inhibitors PDE5A, PDE3A, PDE3B PDE5A 1/4885ABCB1 1581/4885ABCG2 2662/4885

“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.