SCHEMBL5407727

SCHEMBL5407727

CC(C)Cn1c(=O)n(C)c(=O)c2c(-c3ccncc3)n(Cc3cccc(Oc4ccccc4)c3)nc21

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 6/20 0.45
PDE1B Q01064 6/20 0.45
PDE1C Q14123 6/20 0.45
PDE2A O00408 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FAAH O00519 1/20 0.41
HIF1A Q16665 2/20 0.39
TSHR P16473 1/20 0.37

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
SCHEMBL5419589 0.90 PDE1A (0.52) PDE1APDE1BPDE1CPDE2AMEN1
SCHEMBL5398896 0.89 PCSK9 (0.43) PDE1APDE1BPDE1CHIF1A
SCHEMBL5403451 0.87 PDE1A (0.44) PDE1APDE1BPDE1CPDE2AMEN1
SCHEMBL5393375 0.87 KMT2A (0.46) PDE1APDE1BPDE1CPDE2AMEN1
SCHEMBL5402553 0.87 PDE1A (0.41) PDE1APDE1BPDE1CPDE2AMEN1
SCHEMBL5411300 0.85 PDE1A (0.41) PDE1APDE1BPDE1CPDE2AMEN1
SCHEMBL5400574 0.84 ADORA2B (0.48) PDE1APDE1BPDE1CALDH1A1SMN1; SMN2
SCHEMBL5393363 0.84 PDE1A (0.40) PDE1APDE1BPDE1CPDE2AALDH1A1
SCHEMBL5409792 0.83 HIF1A (0.45) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5398457 0.82 HIF1A (0.43) PDE1APDE1BPDE1CMEN1KMT2A

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
US-7285558-B2 Pyrazolo[3,4-d]pyrimidines inhibiting H. pylori infections ASTRAZENECA AB (SE) 2007-10-23 US disclosed
US-20040254183-A1 Pyrazolo[3,4-d]pyrimidines inhibiting h. pylori infections ASTRAZENECA AB (SE) 2004-12-16 US disclosed
EP-1412355-A1 NEW PYRAZOLO(3,4-D)PYRIMIDINES INHIBITING H. PYLORI INFECTIONS AstraZeneca AB (SE) 2004-04-28 EP disclosed
WO-2003002567-A1 NEW PYRAZOLO[3,4-D]PYRIMIDINES INHIBITING H. PYLORI INFECTIONS ASTRAZENECA AB (SE) 2003-01-09 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-20040254183-A1 Pyrazolo[3,4-d]pyrimidines inhibiting h. pylori infections DPYD, HPGDS, PGC PDE1A 4056/4885PDE1B 4206/4885PDE1C 4660/4885

“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.