SCHEMBL3274308

SCHEMBL3274308

COc1cc(N)c(Cl)cc1C(=O)NCCc1nc(-c2ccncn2)cc(=O)n1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 10/20 0.48
DRD4 P21917 2/20 0.46
HTR3E A5X5Y0 2/20 0.46
HTR3B O95264 2/20 0.46
HTR3A P46098 2/20 0.46
HTR3D Q70Z44 2/20 0.46
HTR3C Q8WXA8 2/20 0.46
SLC22A1 O15245 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MPO P05164 1/20 0.46
CYP1A2 P05177 1/20 0.46
ADRA2A P08913 1/20 0.46
CYP2D6 P10635 1/20 0.46
DRD2 P14416 1/20 0.46
ADRA2C P18825 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
DRD3 P35462 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL3274005 0.92 HTR4 (0.45) HTR4DRD4HTR3EHTR3BHTR3A
SCHEMBL3280340 0.87 GSK3B (0.42) LMNACYP1A2CYP2D6GSK3B
SCHEMBL3278108 0.85 GSK3B (0.44) DRD4CYP1A2CYP2D6DRD2GSK3B
SCHEMBL3274941 0.84 GSK3B (0.51) CYP1A2CYP2D6RAB9AGSK3B
SCHEMBL3274431 0.84 NPSR1 (0.44) ALDH1A1LMNACYP1A2CYP2D6DRD2
SCHEMBL3274046 0.82 NPC1 (0.49) CYP1A2CYP2D6RAB9AGSK3B
SCHEMBL3273631 0.81 HTR4 (0.41) HTR4CYP1A2ADRA2ACYP2D6ADRA2C
SCHEMBL3274906 0.80 GSK3B (0.42) CYP1A2CYP2D6GSK3B
SCHEMBL3275516 0.80 GSK3B (0.42) CYP1A2CYP2D6GSK3B
SCHEMBL3274904 0.79 GSK3B (0.42) CYP1A2CYP2D6GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2160388-B1 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI SA (FR) 2013-12-18 EP claimed
US-8598187-B2 Arylamide pyrimidone compounds SANOFI (FR) 2013-12-03 US claimed
US-20100087461-A1 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI-AVENTIS (FR) 2010-04-08 US claimed
EP-2160388-A2 ARYLAMIDE PYRIMIDONE COMPOUNDS Sanofi-Aventis (FR) 2010-03-10 EP claimed
WO-2008155670-A2 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI-AVENTIS (FR) 2008-12-24 WO claimed
EP-1992620-A1 Arylamide pyrimidone derivatives for the treatment of neurodegenerative diseases Sanofi-Aventis (FR) 2008-11-19 EP claimed
EP-1992625-A1 Arylamide pyrimidone compounds Sanofi-Aventis (FR) 2008-11-19 EP claimed
EP-2160388-B1 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI SA (FR) 2013-12-18 EP disclosed
US-8598187-B2 Arylamide pyrimidone compounds SANOFI (FR) 2013-12-03 US disclosed
US-20100087461-A1 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI-AVENTIS (FR) 2010-04-08 US disclosed
EP-2160388-A2 ARYLAMIDE PYRIMIDONE COMPOUNDS Sanofi-Aventis (FR) 2010-03-10 EP disclosed
WO-2008155670-A2 ARYLAMIDE PYRIMIDONE COMPOUNDS SANOFI-AVENTIS (FR) 2008-12-24 WO disclosed
EP-1992625-A1 Arylamide pyrimidone compounds Sanofi-Aventis (FR) 2008-11-19 EP 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-20100087461-A1 ARYLAMIDE PYRIMIDONE COMPOUNDS DHFR, HPRT1, XDH HTR4 1433/4885DRD4 1913/4885HTR3E 2304/4885

“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.