SCHEMBL5415437

SCHEMBL5415437

CC(C)Cn1c(=O)n(C)c(=O)c2c(-c3cccc(OCCO)c3)n(Cc3cc(Cl)cc(Cl)c3)nc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 4/20 0.41
PDE1B Q01064 4/20 0.41
PDE1C Q14123 4/20 0.41
TRPC5 Q9UL62 3/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
PDE2A O00408 2/20 0.37
USP1 O94782 1/20 0.36
KCNH2 Q12809 1/20 0.36
TRPC4 Q9UBN4 1/20 0.36
ADORA2A P29274 1/20 0.35
SLC16A3 O15427 1/20 0.35
SLC16A1 P53985 1/20 0.35
MCTS1 Q9ULC4 1/20 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
SCHEMBL5407635 0.87 SLC16A3 (0.38) PDE1APDE1BPDE1CKMT2AMEN1
SCHEMBL5395878 0.86 HIF1A (0.43) KMT2AMEN1SLC16A3SLC16A1MCTS1
SCHEMBL5404486 0.85 PDE1A (0.49) PDE1APDE1BPDE1CKMT2AMEN1
SCHEMBL5400113 0.84 SLC16A1 (0.47) PDE1APDE1BPDE1CSLC16A1
SCHEMBL5402582 0.83 SLC16A1 (0.42) SLC16A1
SCHEMBL5407470 0.82 PDE1A (0.42) PDE1APDE1BPDE1CKMT2AMEN1
SCHEMBL5415120 0.82 PDE1A (0.37) PDE1APDE1BPDE1CTRPC5KMT2A
SCHEMBL5407655 0.82 SLC16A1 (0.37) PDE1APDE1BPDE1CKMT2AMEN1
SCHEMBL5395967 0.81 NPBWR1 (0.41) KMT2AMEN1SLC16A3SLC16A1
SCHEMBL5400772 0.79 PDE1A (0.39) PDE1APDE1BPDE1CTRPC5KMT2A

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.