SCHEMBL5419638

SCHEMBL5419638

Cc1c(F)cccc1Cn1nc2c(c1-c1ccncc1)c(=O)n(C)c(=O)n2CC(C)C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 6/20 0.39
PDE1B Q01064 6/20 0.39
PDE1C Q14123 6/20 0.39
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
SLC16A1 P53985 2/20 0.35
PDE2A O00408 3/20 0.34
PDE5A O76074 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CFTR P13569 1/20 0.34
TSHR P16473 1/20 0.34
PDE4A P27815 1/20 0.34
MAPK1 P28482 1/20 0.34
ADORA1 P30542 1/20 0.34
SCN1A P35498 1/20 0.34
PDE6C P51160 1/20 0.34

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
SCHEMBL5399629 0.92 PDE1A (0.38) PDE1APDE1BPDE1CALDH1A1LMNA
SCHEMBL6677611 0.86 PDE1A (0.36) PDE1APDE1BPDE1CSLC16A1PDE2A
SCHEMBL5400486 0.85 SLC16A1 (0.43) ALDH1A1GRIN1GRIN2BSLC16A1TSHR
SCHEMBL5395371 0.85 SLC16A1 (0.52) PDE1APDE1BPDE1CALDH1A1LMNA
SCHEMBL5404652 0.84 RIPK3 (0.41) PDE1APDE1BPDE1CLMNAPDE5A
SCHEMBL5419589 0.82 PDE1A (0.52) PDE1APDE1BPDE1CPDE2AADORA1
SCHEMBL5404641 0.82 CHRM1 (0.38) PDE1APDE1BPDE1CPDE2APDE5A
SCHEMBL5405541 0.82 PDE5A (0.39) PDE1APDE1BPDE1CSLC16A1PDE2A
SCHEMBL5403011 0.82 ADORA2A (0.40) PDE1APDE1BPDE1CSLC16A1PDE5A
SCHEMBL5395309 0.82 PDE1A (0.37) PDE1APDE1BPDE1CLMNASLC16A1

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.