SCHEMBL5404486

SCHEMBL5404486

CC(C)Cn1c(=O)n(C)c(=O)c2c(-c3ccccc3)n(Cc3cc(Cl)cc(Cl)c3)nc21

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 6/20 0.49
PDE1B Q01064 6/20 0.49
PDE1C Q14123 6/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PDE2A O00408 4/20 0.45
HPGD P15428 1/20 0.41
DPP4 P27487 1/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39

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 0.86 PDE1A (0.52) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5404326 0.86 PDE1A (0.42) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5415437 0.85 PDE1A (0.41) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5403396 0.85 PDE1A (0.43) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5408187 0.83 PDE1A (0.45) PDE1APDE1BPDE1CPDE2AADORA1
SCHEMBL5407603 0.82 PDE1A (0.40) PDE1APDE1BPDE1CPDE2AADORA1
SCHEMBL3091849 0.82 PDE1B (0.54) PDE1APDE1BPDE1CMEN1KMT2A
SCHEMBL5404189 0.81 PDE1A (0.39) PDE1APDE1BPDE1CPDE2AADORA1
SCHEMBL5400757 0.81 PDE1A (0.45) PDE1APDE1BPDE1CPDE2AADORA2A
SCHEMBL5410732 0.80 PDE1A (0.41) PDE1APDE1BPDE1CPDE2AALDH1A1

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 2 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

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.