SCHEMBL5400124

SCHEMBL5400124

CC(=O)Oc1ccc(Cn2c(=O)n(C)c(=O)c3c(-c4ccncc4)n(Cc4cccc5ccccc45)nc32)cc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 10/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
TSHR P16473 3/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
USP2 O75604 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL5398362 0.90 ALDH1A1 (0.41) NPBWR1MEN1KMT2AALDH1A1LMNA
SCHEMBL5402662 0.89 MEN1 (0.40) NPBWR1MEN1KMT2AALDH1A1LMNA
SCHEMBL5393463 0.89 HPGD (0.44) NPBWR1MEN1KMT2AALDH1A1LMNA
SCHEMBL5403289 0.88 NPBWR1 (0.49) NPBWR1ALDH1A1LMNATSHRMAPT
SCHEMBL5410870 0.87 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL5408070 0.86 PIK3CD (0.42) NPBWR1MEN1KMT2AALDH1A1LMNA
SCHEMBL5400616 0.85 CMA1 (0.42) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL5404180 0.85 ALDH1A1 (0.45) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL5404061 0.84 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL5398294 0.84 ALDH1A1 (0.40) NPBWR1MEN1KMT2AALDH1A1LMNA

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 NPBWR1 3728/4885MEN1 4216/4885KMT2A 3837/4885

“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.