SCHEMBL5405558

SCHEMBL5405558

CC(=O)Nc1ccc(-c2c3c(=O)n(C)c(=O)n(CC(C)C)c3nn2Cc2ccnc3ccccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 4/20 0.47
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
SLC16A7 O60669 1/20 0.42
PDE1A P54750 1/20 0.40
PDE1B Q01064 1/20 0.40
PDE1C Q14123 1/20 0.40

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
SCHEMBL5405288 0.90 SLC16A1 (0.47) SLC16A1TP53MAPTCYP3A4CYP2C9
SCHEMBL5395864 0.88 SLC16A1 (0.47) SLC16A1
SCHEMBL5405554 0.88 SLC16A1 (0.47) SLC16A1CYP3A4CYP2C9SLC16A7
SCHEMBL5418116 0.87 SLC16A1 (0.46) SLC16A1
SCHEMBL5400652 0.87 MAPT (0.48) SLC16A1TP53MAPTPDE1APDE1B
SCHEMBL5405716 0.86 TP53 (0.44) SLC16A1TP53MAPTPDE1APDE1B
SCHEMBL6659477 0.83 TP53 (0.41) TP53MAPTPDE1APDE1BPDE1C
SCHEMBL5411378 0.83 TP53 (0.45) TP53MAPTPDE1APDE1BPDE1C
SCHEMBL5407653 0.83 TP53 (0.40) TP53MAPTPDE1APDE1BPDE1C
SCHEMBL5400727 0.83 TP53 (0.39) TP53MAPTPDE1APDE1BPDE1C

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 SLC16A1 4140/4885TP53 1580/4885MAPT 4180/4885

“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.