SCHEMBL4264243

SCHEMBL4264243

CS(=O)(=O)CCN1CCCN(c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
SIRT6 Q8N6T7 1/20 0.56
MAPT P10636 3/20 0.55
ALDH1A1 P00352 1/20 0.51
HTR1A P08908 2/20 0.51
KCNJ1 P48048 1/20 0.50
KCNH2 Q12809 1/20 0.50
KMT2A Q03164 1/20 0.49
POLB P06746 3/20 0.49
CTSK P43235 1/20 0.48

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
SCHEMBL1815442 0.95 SIRT6 (0.61) LMNASIRT6MAPTALDH1A1HTR1A
SCHEMBL10511652 0.84 LMNA (0.68) LMNASIRT6MAPTALDH1A1HTR1A
SCHEMBL18463446 0.83 SIRT6 (0.60) LMNASIRT6MAPTALDH1A1HTR1A
SCHEMBL4258572 0.83 MAPT (0.54) LMNAMAPTALDH1A1KMT2APOLB
SCHEMBL5209234 0.83 MAPT (0.67) LMNASIRT6MAPTHTR1AKCNJ1
SCHEMBL12431530 0.82 MAPT (0.70) LMNASIRT6MAPTALDH1A1HTR1A
SCHEMBL5206660 0.82 LMNA (0.63) LMNASIRT6MAPTHTR1AKMT2A
SCHEMBL7048817 0.79 MAPT (0.85) LMNASIRT6MAPTALDH1A1KMT2A
SCHEMBL6690060 0.79 LMNA (0.60) LMNASIRT6MAPTHTR1AKMT2A
SCHEMBL1045292 0.78 SIRT6 (0.69) LMNASIRT6MAPTALDH1A1HTR1A

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 LMNA 4077/4885SIRT6 1896/4885MAPT 4471/4885

“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.