SCHEMBL5236162

SCHEMBL5236162

CCN(CCO)c1ccc(-c2nc3c(C)nn(-c4ccccc4)c3c(=O)[nH]2)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.44
PDE7A Q13946 1/20 0.43
PDE7B Q9NP56 1/20 0.43
CRHR1 P34998 1/20 0.40
KDM4E B2RXH2 2/20 0.37
DHODH Q02127 1/20 0.37
POLB P06746 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.36

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
Hydrochloric Acid SCHEMBL5266194 0.99 PDE5A (0.44) PDE5APDE7APDE7BCRHR1KDM4E
SCHEMBL5231480 0.90 PDE7A (0.44) PDE5APDE7APDE7BKDM4EDHODH
SCHEMBL5234508 0.88 PDE5A (0.42) PDE5APDE7APDE7BKDM4ETP53
SCHEMBL5232880 0.87 PDE5A (0.41) PDE5APDE7APDE7BKDM4EDHODH
SCHEMBL5236155 0.82 PDE7A (0.67) PDE7APDE7B
SCHEMBL5228674 0.82 PDE7A (0.42) PDE5APDE7APDE7BTP53
SCHEMBL5233333 0.82 ALDH1A1 (0.51) PDE5APDE7APDE7BKDM4EPOLB
SCHEMBL5230277 0.82 PDE7A (0.43) PDE5APDE7APDE7BTP53
Hydrochloric Acid SCHEMBL5234845 0.82 PDE7A (0.66) PDE7APDE7B
SCHEMBL5233250 0.81 PDE7A (0.50) PDE5APDE7APDE7BKDM4EDHODH

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 PDE5A 8/4885PDE7A 4/4885PDE7B 1/4885

“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.