SCHEMBL5402595

SCHEMBL5402595

Cn1cnc(S(=O)(=O)NC(C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
KMT2A Q03164 5/20 0.52
TSHR P16473 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 4/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 2/20 0.46
GLO1 Q04760 1/20 0.46
FBP1 P09467 1/20 0.41
HTR6 P50406 1/20 0.39
KAT5 Q92993 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL4070446 0.79 LMNA (0.55) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL5403024 0.78 TSHR (0.52) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL289059 0.78 LMNA (0.54) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL420412 0.78 LMNA (0.54) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL5899464 0.76 LMNA (0.52) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL12878853 0.76 TSHR (0.45) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL7921928 0.75 LMNA (0.51) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL13892301 0.75 LMNA (0.63) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL6098517 0.74 LMNA (0.61) LMNAKMT2ATSHRL3MBTL1GAA
SCHEMBL19350976 0.74 LMNA (0.50) LMNAKMT2ATSHRL3MBTL1GAA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 US disclosed
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 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
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 (2 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 4673/4885KMT2A 3837/4885TSHR 3317/4885
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands CNR1, CNR2, OPRL1 LMNA 4434/4885KMT2A 2274/4885TSHR 365/4885

“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.