SCHEMBL5230219

SCHEMBL5230219

Cc1nn(-c2ccccc2)c2c(=O)[nH]c(-c3ccc(N4CCN(C)CC4)cc3)nc12

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNKS O95271 2/20 0.55
PARP1 P09874 2/20 0.55
TNKS2 Q9H2K2 2/20 0.55
KHK P50053 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 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
SCHEMBL5229711 0.87 CFTR (0.52) TNKSPARP1TNKS2KHK
SCHEMBL5232141 0.85 KDM4E (0.52) TNKSPARP1TNKS2KDM4EMAPT
SCHEMBL5235453 0.83 PDE7A (0.48) KHKKDM4EALDH1A1MAPT
SCHEMBL5232557 0.82 TNKS (0.52) TNKSPARP1TNKS2KDM4EMAPT
SCHEMBL5229885 0.81 PDE5A (0.58) KHKKDM4EALDH1A1
SCHEMBL5230207 0.80 PDE7A (0.53) TNKSPARP1TNKS2
SCHEMBL5228261 0.79 TNKS (0.51) TNKSPARP1TNKS2KDM4EALDH1A1
SCHEMBL5229820 0.79 TNKS (0.51) TNKSPARP1TNKS2KDM4EALDH1A1
SCHEMBL5228258 0.79 TNKS (0.51) TNKSPARP1TNKS2KDM4EALDH1A1
SCHEMBL1814076 0.79 PDE5A (0.41) PARP1KHKKDM4EALDH1A1MAPT

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 TNKS 1602/4885PARP1 3442/4885TNKS2 1778/4885

“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.