SCHEMBL4046258

SCHEMBL4046258

Cc1nc2sc(C(N)=O)c(N)c2c2c1CCC(C)(C)C2

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.69
KDM4E B2RXH2 3/20 0.69
ATM Q13315 2/20 0.69
NPC1 O15118 1/20 0.69
HTT P42858 1/20 0.69
EEF2K O00418 16/20 0.57
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52

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
SCHEMBL5242992 0.87 MAPT (0.53) MAPTKDM4EATMNPC1HTT
SCHEMBL4051773 0.85 EEF2K (0.54) MAPTKDM4EATMNPC1HTT
SCHEMBL4047809 0.82 EEF2K (0.52) MAPTKDM4EATMNPC1HTT
SCHEMBL4052747 0.82 KDM4E (0.58) MAPTKDM4EATMNPC1HTT
SCHEMBL4051300 0.82 KDM4E (0.71) MAPTKDM4EATMNPC1HTT
SCHEMBL4046385 0.80 KDM4E (0.59) MAPTKDM4EATMNPC1HTT
SCHEMBL4045460 0.80 KDM4E (0.59) MAPTKDM4EATMHTTEEF2K
SCHEMBL4047805 0.80 EEF2K (0.50) MAPTKDM4EATMNPC1HTT
SCHEMBL4053028 0.80 KDM4E (0.72) MAPTKDM4EATMHTTALDH1A1
SCHEMBL4054309 0.78 EEF2K (0.72) MAPTKDM4EHTTEEF2KALDH1A1

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
EP-1819710-B1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES ALMIRALL LAB (ES) 2009-03-11 EP disclosed
US-20090029955-A1 Pyridothienopyrimidine Derivatives ALMIRALL PRODESFARMA S.A. (ES) 2009-01-29 US disclosed
EP-1819710-A1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES Laboratorios Almirall, S.A. (ES) 2007-08-22 EP disclosed
WO-2006058724-A1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES LABORATORIOS ALMIRALL, S.A. (ES) 2006-06-08 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-20090029955-A1 Pyridothienopyrimidine Derivatives PNPO, PDE4A, DPYD MAPT 2618/4885KDM4E 1600/4885ATM 2297/4885

“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.