SCHEMBL5229711

SCHEMBL5229711

Cc1nn(-c2ccccc2)c2c(=O)[nH]c(-c3ccc(N4CCC(O)CC4)cc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.52
KHK P50053 3/20 0.46
TNKS O95271 1/20 0.41
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
PDE7A Q13946 1/20 0.41

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
SCHEMBL5230219 0.87 TNKS (0.55) KHKTNKSPARP1TNKS2
SCHEMBL5230543 0.84 PDE7A (0.62) CFTRPDE7A
SCHEMBL5232141 0.82 KDM4E (0.52) TNKSPARP1TNKS2
SCHEMBL5229705 0.82 PDE7A (0.56) PDE7A
SCHEMBL5231978 0.82 PDE5A (0.53) CFTRPDE7A
SCHEMBL1813460 0.80 PDE7A (0.44) CFTRPDE7A
SCHEMBL5232557 0.80 TNKS (0.52) TNKSPARP1TNKS2
SCHEMBL5232097 0.79 PDE7A (0.63) PDE7A
SCHEMBL1813361 0.78 PDE5A (0.46) CFTRPDE7A
SCHEMBL14395315 0.77 PDE7A (0.38) CFTRKHKTNKSPARP1TNKS2

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
EP-1454897-B1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7-INHIBITORY ACTIVITY ASUBIO PHARMA CO LTD (JP) 2007-10-10 EP disclosed
US-7268128-B2 1,3,5-trisubstituted-5-phenyl and 5-pyridyl pyrazolopyrimidinone derivatives having PDE7 inhibiting action AUSBIO PHARMA CO., LTD. (JP) 2007-09-11 US disclosed
US-20050148604-A1 Pyrazolopyrimidinone derivatives having PDE7 inhibiting action OMEROS CORPORATION 2005-07-07 US disclosed
EP-1454897-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7−INHIBITORY ACTIVITY Daiichi Suntory Pharma Co., Ltd. (JP) 2004-09-08 EP 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-20050148604-A1 Pyrazolopyrimidinone derivatives having PDE7 inhibiting action PDE7B, PDE3B, PDE3A CFTR 536/4885KHK 2017/4885TNKS 1602/4885

“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.