SCHEMBL4900976

SCHEMBL4900976

CCCOc1ccc(S(=O)(=O)N(CC)C2CCCN2C)cc1C(=O)Nc1c(CCC)nn(C)c1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.50
PDE5A O76074 9/20 0.39
PDE3B Q13370 1/20 0.34
PDE3A Q14432 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
SCHEMBL4741016 0.82 PDE5A (0.58) TERTPDE5A
SCHEMBL1706222 0.82 TERT (0.49) TERTPDE5A
SCHEMBL1705329 0.82 TERT (0.61) TERTPDE5A
SCHEMBL13990468 0.80 TERT (0.53) TERTPDE5A
SCHEMBL8055436 0.80 PDE5A (0.56) TERTPDE5A
SCHEMBL5739554 0.79 TERT (0.50) TERTPDE5APDE3BPDE3A
SCHEMBL8125815 0.78 TERT (0.62) TERTPDE5APDE3BPDE3A
SCHEMBL8055439 0.77 TERT (0.54) TERTPDE5A
SCHEMBL4565717 0.77 TERT (0.56) TERTPDE5APDE3BPDE3A
SCHEMBL7253729 0.77 TERT (0.58) TERTPDE5A

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
US-20080194529-A1 HIGHLY SELECTIVE and LONG-ACTING PDE5 MODULATORS AUSPEX PHARMACEUTICALS, INC. (US) 2008-08-14 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 (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-20080194529-A1 HIGHLY SELECTIVE and LONG-ACTING PDE5 MODULATORS PDE5A, PDE7A, PDE3A TERT 3651/4885PDE5A 1/4885PDE3B 6/4885

“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.