SCHEMBL23923868

SCHEMBL23923868

CCCc1cn(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CCN(CCOC(=O)CCCCCO[N+](=O)[O-])CC4)ccc3OCC)[nH]c12

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.68
HDAC1 Q13547 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL21705352 0.91 PDE5A (0.68) PDE5A
SCHEMBL21705157 0.91 PDE5A (0.83) PDE5AHDAC1HDAC6HDAC2
SCHEMBL21705393 0.90 PDE5A (0.60) PDE5AHDAC1HDAC6HDAC2
SCHEMBL21705397 0.89 PDE5A (0.79) PDE5AHDAC1HDAC6HDAC2
SCHEMBL21705395 0.84 PDE5A (0.70) PDE5A
SCHEMBL21682533 0.83 PDE5A (0.95) PDE5AHDAC1HDAC6HDAC2
SCHEMBL21682493 0.83 PDE5A (0.83) PDE5A
SCHEMBL21705156 0.82 PDE5A (0.69) PDE5A
SCHEMBL21705134 0.81 PDE5A (0.62) PDE5A
SCHEMBL18539070 0.81 PDE5A (0.63) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245684-A1 NITRIC OXIDE RELEASING PHOSPHODIESTERASE TYPE 5 INHIBITOR NICOX S.A. (FR) 2024-07-25 US claimed
US-20210322413-A1 NITRIC OXIDE RELEASING PHOSPHODIESTERASE TYPE 5 INHIBITOR NICOX S.A. (FR) 2021-10-21 US claimed
CN-112566670-A Nitric oxide releasing phosphodiesterase type 5 inhibitors 尼科斯股份有限公司 2021-03-26 CN claimed
US-20240245684-A1 NITRIC OXIDE RELEASING PHOSPHODIESTERASE TYPE 5 INHIBITOR NICOX S.A. (FR) 2024-07-25 US disclosed
CN-112566670-A Nitric oxide releasing phosphodiesterase type 5 inhibitors 尼科斯股份有限公司 2021-03-26 CN 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-20210322413-A1 NITRIC OXIDE RELEASING PHOSPHODIESTERASE TYPE 5 INHIBITOR PDE5A, PDE6A, PDE3A PDE5A 1/4885HDAC1 1298/4885HDAC6 1620/4885
US-20240245684-A1 NITRIC OXIDE RELEASING PHOSPHODIESTERASE TYPE 5 INHIBITOR PDE5A, PDE3A, PDE6A PDE5A 1/4885HDAC1 1159/4885HDAC6 1892/4885

“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.