SCHEMBL3275205

SCHEMBL3275205

Cn1c(CCNC(=O)c2ccccc2OC(F)(F)F)nc(-c2ccncn2)cc1=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 15/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HCN1 O60741 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 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
SCHEMBL3641872 0.93 GSK3B (0.39) GSK3BMAPTNPC1TP53RAB9A
SCHEMBL3278164 0.91 HCN1 (0.40) GSK3BHCN1CYP1A2CYP2D6
SCHEMBL3275008 0.87 RECQL (0.44) GSK3BTP53CYP1A2CYP2D6
SCHEMBL3274941 0.84 GSK3B (0.51) GSK3BMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3274046 0.83 NPC1 (0.49) GSK3BMAPTNPC1TP53RAB9A
SCHEMBL3274817 0.83 NPC1 (0.47) GSK3BMAPTNPC1TP53RAB9A
SCHEMBL3274219 0.82 GSK3B (0.49) GSK3BMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3274906 0.82 GSK3B (0.42) GSK3BMAPTMEN1KMT2ACYP1A2
SCHEMBL3273287 0.81 POLB (0.52) GSK3BTP53RAB9ACYP1A2CYP2D6
SCHEMBL3280340 0.80 GSK3B (0.42) GSK3BMAPTTP53KMT2ACYP1A2

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 8 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-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

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 GSK3B 3294/4885MAPT 3080/4885NPC1 695/4885

“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.