SCHEMBL4253253

SCHEMBL4253253

Cc1cc(N2CCC(CN(C)C)C2)ccc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
RAD52 P43351 2/20 0.49
BPTF Q12830 1/20 0.40
LGMN Q99538 2/20 0.38
SUV39H2 Q9H5I1 2/20 0.36
MAPT P10636 8/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPK1 P28482 7/20 0.34
TDP1 Q9NUW8 5/20 0.34
ATM Q13315 2/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
DPP4 P27487 2/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
CHRNA4 P43681 2/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL27760675 0.89 BPTF (0.40) GAARAD52BPTFLGMNSUV39H2
SCHEMBL1537908 0.83 GAA (0.51) GAARAD52BPTFLGMNMAPT
SCHEMBL9041963 0.79 IP6K1 (0.40) BPTFLGMNMAPTKDM4EMAPK1
SCHEMBL1750140 0.79 GAA (0.49) GAARAD52
SCHEMBL4299094 0.79 GAA (0.49) GAARAD52
SCHEMBL4253950 0.79 GAA (0.49) GAARAD52
SCHEMBL29218858 0.79 GAA (0.63) GAARAD52LGMNMAPTKDM4E
SCHEMBL24206625 0.77 GAA (0.57) GAARAD52LGMNSUV39H2MAPT
SCHEMBL1749967 0.77 MAPT (0.49) GAARAD52LGMNMAPTKDM4E
SCHEMBL5390127 0.77 GAA (0.53) GAARAD52LGMNSUV39H2MAPT

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-8828991-B2 Azacyclyl-substituted arylthienopyrimidinones, process for their preparation and their use as medicaments SANOFI (FR) 2014-09-09 US disclosed
US-20090082339-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (FR) 2009-03-26 US disclosed
EP-1986646-A1 NOVEL AZACYCLY-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS Sanofi-Aventis (FR) 2008-11-05 EP disclosed
WO-2007093363-A1 NOVEL AZACYCLY-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (DE) 2007-08-23 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-20090082339-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS MCHR1, MPI, TPMT GAA 1428/4885RAD52 4571/4885BPTF 2891/4885

“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.