SCHEMBL5229283

SCHEMBL5229283

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

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
PDE7A Q13946 1/20 0.41
PDE7B Q9NP56 1/20 0.41
PDE5A O76074 3/20 0.40
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.36
POLB P06746 2/20 0.35

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
SCHEMBL5228687 0.95 ALDH1A1 (0.42) ALDH1A1PDE7APDE7BPDE5AMAPT
SCHEMBL5233333 0.91 ALDH1A1 (0.51) ALDH1A1PDE7APDE7BPDE5AMAPT
SCHEMBL5231384 0.91 PDE7A (0.44) ALDH1A1PDE7APDE7BPDE5AMAPT
SCHEMBL5236398 0.86 PDE5A (0.46) PDE7APDE7BPDE5AMAPTKDM4E
SCHEMBL5230277 0.85 PDE7A (0.43) PDE7APDE7BPDE5A
SCHEMBL5234570 0.85 PDE7A (0.47) ALDH1A1PDE7APDE7BPDE5ANPSR1
SCHEMBL5228288 0.85 PDE5A (0.47) PDE7APDE7BPDE5AMAPT
SCHEMBL5229274 0.83 PDE7A (0.64) PDE7APDE7B
SCHEMBL5228674 0.83 PDE7A (0.42) PDE7APDE7BPDE5A
SCHEMBL5230059 0.82 PDE7A (0.47) PDE7APDE7BPDE5A

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 ALDH1A1 711/4885PDE7A 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.