SCHEMBL9103233

SCHEMBL9103233

CC(C)(F)c1cc(Cl)cc(Oc2ccc(CCOC(=N)N)cc2)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
ST14 Q9Y5Y6 4/20 0.35
TLR8 Q9NR97 2/20 0.34
FFAR1 O14842 1/20 0.33
PPARG P37231 3/20 0.33
F2 P00734 1/20 0.32
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
GRIN2B Q13224 1/20 0.31
MAOB P27338 1/20 0.30
MAPK14 Q16539 1/20 0.30
PPARD Q03181 2/20 0.30
PPARA Q07869 2/20 0.30

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
SCHEMBL9107800 0.91 TLR8 (0.41) CARM1PRMT6ST14TLR8FFAR1
SCHEMBL9103241 0.84 CARM1 (0.41) CARM1PRMT6TLR8FFAR1PPARG
SCHEMBL9105909 0.78 IDO1 (0.46) FFAR1MAOBMAPK14
SCHEMBL9105853 0.76 LTA4H (0.46) TLR8FFAR1F2MAOBMAPK14
SCHEMBL9889539 0.76 ST14 (0.34) ST14FFAR1PPARGF2MAOB
SCHEMBL9108070 0.75 PLA2G7 (0.47) FFAR1PPARGPPARA
SCHEMBL9106011 0.74 CHEK2 (0.40) ST14PPARGF2S1PR1PPARA
SCHEMBL9107802 0.74 TLR8 (0.46) CARM1PRMT6TLR8FFAR1MAPK14
SCHEMBL9892542 0.74 EPHX1 (0.39) ST14FFAR1PPARGF2GRIN2B
SCHEMBL9108158 0.73 KMT2A (0.40) ST14PPARG

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 CARM1 4832/4885PRMT6 4135/4885ST14 4540/4885
US-20120142717-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 CARM1 4832/4885PRMT6 4135/4885ST14 4540/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B CARM1 4746/4885PRMT6 3439/4885ST14 4559/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B CARM1 4731/4885PRMT6 3412/4885ST14 4591/4885

“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.