SCHEMBL7168262

SCHEMBL7168262

CCc1cc(C#N)cc2c(NCc3ccc(OC)c(Cl)c3)c(COC[C@@H]3CCCN3C(=O)OC(C)(C)C)cnc12

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.63
PDE6D O43924 2/20 0.54
PDE6A P16499 2/20 0.54
PDE6G P18545 2/20 0.54
PDE6B P35913 2/20 0.54
PDE6C P51160 2/20 0.54
PDE6H Q13956 2/20 0.54

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
SCHEMBL7163190 1.00 PDE5A (0.63) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7170206 0.89 PDE5A (0.54) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL6695047 0.88 PDE5A (0.70) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL6689151 0.86 PDE5A (0.68) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7163255 0.84 PDE5A (0.63) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7166275 0.81 PDE5A (0.52) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7171984 0.81 PDE5A (0.72) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL5537736 0.81 PDE5A (0.72) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL6689536 0.81 PDE5A (0.72) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL6697475 0.81 PDE5A (0.85) PDE5APDE6DPDE6APDE6GPDE6B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225128-A1 Quinoline inhibitors of cGMP phosphodiesterase BI YINGZHI (US) 2003-12-04 US claimed
US-6576644-B2 Treating sexual dysfunction including erectile dysfunction, diabetes melitus, gastrointestinal disorders, including gastric paresis and cardiovascular disorders; cyclic guanosine 3',5'-monophosphate (cGMP) BRISTOL-MYERS SQUIBB CO. 2003-06-10 US claimed
US-20020177587-A1 Quinoline inhibitors of cGMP phosphodiesterase BRISTOL-MYERS SQUIBB COMPANY 2002-11-28 US claimed

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-20030225128-A1 Quinoline inhibitors of cGMP phosphodiesterase PDE5A, PDE3A, PDE2A PDE5A 1/4885PDE6D 24/4885PDE6A 6/4885
US-20020177587-A1 Quinoline inhibitors of cGMP phosphodiesterase PDE5A, PDE2A, PDE3A PDE5A 1/4885PDE6D 27/4885PDE6A 13/4885

“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.