SCHEMBL5399540

SCHEMBL5399540

CC(=O)Nc1cn(C)c(-c2c3c(=O)n(C)c(=O)n(CC(C)C)c3nn2Cc2csc3ccccc23)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
SLC16A1 P53985 3/20 0.36
SHMT2 P34897 1/20 0.36
PDE1A P54750 1/20 0.35
PDE1B Q01064 1/20 0.35
PDE1C Q14123 1/20 0.35
CMA1 P23946 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 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
SCHEMBL5410898 0.90 CTSL (0.34) LMNASLC16A1SHMT2PDE1APDE1B
SCHEMBL5406059 0.86 SLC16A1 (0.39) LMNASLC16A1PDE1APDE1BPDE1C
Hydrochloric Acid SCHEMBL5402776 0.86 SLC16A1 (0.38) LMNASLC16A1PDE1APDE1BPDE1C
SCHEMBL5405716 0.85 TP53 (0.44) LMNASLC16A1PDE1APDE1BPDE1C
SCHEMBL5402570 0.85 SLC16A1 (0.36) LMNASLC16A1SHMT2PDE1APDE1B
SCHEMBL5398848 0.82 PDE1A (0.37) SLC16A1PDE1APDE1BPDE1C
SCHEMBL5411081 0.81 SMN1; SMN2 (0.41) SLC16A1PDE1APDE1BPDE1CCMA1
SCHEMBL5400117 0.80 CMA1 (0.37) SLC16A1PDE1APDE1BPDE1CCMA1
SCHEMBL5404342 0.80 PDE1A (0.38) SLC16A1PDE1APDE1BPDE1CCMA1
SCHEMBL5395357 0.80 PDE5A (0.39) SLC16A1PDE1APDE1BPDE1CCMA1

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-7285558-B2 Pyrazolo[3,4-d]pyrimidines inhibiting H. pylori infections ASTRAZENECA AB (SE) 2007-10-23 US disclosed
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 LMNA 4673/4885SLC16A1 4140/4885SHMT2 3524/4885

“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.