SCHEMBL5407647

SCHEMBL5407647

CC(=O)Nc1ccccc1-c1c2c(=O)n(C)c(=O)n(CC(C)C)c2nn1Cc1cccc(Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 3/20 0.39
PDE1B Q01064 3/20 0.39
PDE1C Q14123 3/20 0.39
ALDH1A1 P00352 2/20 0.37
TNF P01375 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE2A O00408 1/20 0.35
TRPA1 O75762 1/20 0.35
TP53 P04637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PDE5A O76074 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
SCHEMBL5407653 0.87 TP53 (0.40) PDE1APDE1BPDE1CALDH1A1TNF
SCHEMBL5405554 0.84 SLC16A1 (0.47)
SCHEMBL5395928 0.81 PDE1A (0.38) PDE1APDE1BPDE1CALDH1A1PDE2A
SCHEMBL5393985 0.80 PDE1A (0.40) PDE1APDE1BPDE1CALDH1A1PDE2A
SCHEMBL5407969 0.80 SLC22A12 (0.46) PDE1APDE1BPDE1CSLC22A12SMN1; SMN2
SCHEMBL5413282 0.77 PDE1A (0.42) PDE1APDE1BPDE1CPDE2APDE5A
SCHEMBL6659477 0.76 TP53 (0.41) PDE1APDE1BPDE1CALDH1A1TP53
SCHEMBL5402768 0.73 TP53 (0.38) PDE1APDE1BPDE1CALDH1A1PDE2A
SCHEMBL5405558 0.72 SLC16A1 (0.47) PDE1APDE1BPDE1CTP53
SCHEMBL5400652 0.71 MAPT (0.48) PDE1APDE1BPDE1CALDH1A1TP53

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.