SCHEMBL9106047

SCHEMBL9106047

CCc1ccc(Oc2ncc(C(F)(F)F)cn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LIPE Q05469 2/20 0.41
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RXRA P19793 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
MAOB P27338 2/20 0.37
NPBWR1 P48145 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SCN7A Q01118 1/20 0.37
SCN9A Q15858 1/20 0.37

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
SCHEMBL9106039 0.85 SMN1; SMN2 (0.42) LMNASMN1; SMN2LIPEMAPTMAOB
SCHEMBL12967179 0.81 ACACB (0.41) LMNASMN1; SMN2MAPK1L3MBTL1MAPT
SCHEMBL9103930 0.81 SMN1; SMN2 (0.42) LMNASMN1; SMN2LIPEMAOBSCN7A
SCHEMBL9108246 0.81 LMNA (0.63) LMNASMN1; SMN2LIPEMAPK1MAPT
SCHEMBL12806599 0.79 MEN1 (0.48) LMNAL3MBTL1MAPTATMMAOB
SCHEMBL11097560 0.78 MEN1 (0.45) LMNASMN1; SMN2MAPK1MAPTNPC1
SCHEMBL9102850 0.78 NPSR1 (0.49) LMNASMN1; SMN2L3MBTL1MAPTHPGD
SCHEMBL12806632 0.77 SMN1; SMN2 (0.53) LMNASMN1; SMN2LIPEHPGDATM
SCHEMBL14649861 0.77 SMN1; SMN2 (0.70) LMNASMN1; SMN2LIPEMAPTHPGD
SCHEMBL9106305 0.75 MEN1 (0.57) LMNASMN1; SMN2L3MBTL1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649053-B1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LTD (GB) 2015-11-04 EP disclosed
US-9174968-B2 Pyrimidinone compounds for use in the treatment of diseases or conditions mediated by LP-PLA2 GLAXO GROUP LIMITED (GB) 2015-11-03 US disclosed
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LIMITED (GB) 2015-04-09 US disclosed
US-20140113922-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-04-24 US disclosed
US-8637536-B2 Pyrimidinone compounds for use in the treatment of diseases or conditions mediated by Lp-PLA2 GLAXO GROUP LIMITED (GB) 2014-01-28 US disclosed
EP-2649053-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP - PLA2 Glaxo Group Limited (GB) 2013-10-16 EP disclosed
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
WO-2012076435-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP - PLA2 GLAXO GROUP LIMITED (GB) 2012-06-14 WO disclosed
US-20120142717-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-06-07 US 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 (4 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-20140113922-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 LMNA 512/4885SMN1; SMN2 3782/4885LIPE 74/4885
US-20120142717-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 LMNA 512/4885SMN1; SMN2 3782/4885LIPE 74/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B LMNA 502/4885SMN1; SMN2 2828/4885LIPE 154/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B LMNA 471/4885SMN1; SMN2 2782/4885LIPE 160/4885

“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.