SCHEMBL8295690

SCHEMBL8295690

CCOCCn1nc(C(=O)NC)c2nc(N(C)C3CCN(C)C3)nc(NC3CCCCC3)c21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 13/20 0.45
EHMT2 Q96KQ7 5/20 0.36
EHMT1 Q9H9B1 4/20 0.36
BRAF P15056 1/20 0.34
KCNH2 Q12809 2/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CCNA1 P78396 1/20 0.32

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
SCHEMBL4705161 1.00 PDE5A (0.45) PDE5AEHMT2EHMT1BRAFKCNH2
SCHEMBL8295317 0.82 PDE5A (0.70) PDE5AKCNH2
SCHEMBL4701729 0.82 PDE5A (0.70) PDE5AKCNH2
SCHEMBL14290023 0.82 PDE5A (0.45) PDE5AKCNH2CCNA2CDK2CCNA1
SCHEMBL8294730 0.80 PDE5A (0.45) PDE5AKCNH2CCNA2CDK2CCNA1
SCHEMBL4701231 0.79 PDE5A (0.41) PDE5AEHMT2KCNH2
SCHEMBL4703937 0.79 PDE5A (0.54) PDE5AKCNH2
SCHEMBL4705086 0.77 PDE5A (0.48) PDE5AEHMT2EHMT1KCNH2
SCHEMBL4705183 0.77 PDE5A (0.41) PDE5AEHMT2EHMT1KCNH2
SCHEMBL4703066 0.76 PDE5A (0.41) PDE5AKCNH2

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-1689752-B1 PYRAZOLOPYRIMIDINES PFIZER LTD (GB) 2008-02-27 EP disclosed
US-20070105877-A1 Pyrazolopyrimidines PFIZER INC 2007-05-10 US disclosed
US-20070105877-A1 Pyrazolopyrimidines PFIZER INC 2007-05-10 US disclosed
WO-2005049617-A1 PYRAZOLOPYRIMIDINES PFIZER LIMITED (GB) 2005-06-02 WO 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-20070105877-A1 Pyrazolopyrimidines DPYD, CYP2D6, TPMT PDE5A 724/4885EHMT2 3688/4885EHMT1 3930/4885

“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.