SCHEMBL9889477

SCHEMBL9889477

Cc1cc(Oc2ccc(C=O)cc2C#N)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 5/20 0.51
ESRRA P11474 3/20 0.46
AR P10275 7/20 0.42
TTR P02766 1/20 0.41
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41
KCNH2 Q12809 1/20 0.41
EPAS1 Q99814 1/20 0.40

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
SCHEMBL14661906 0.88 SLC22A12 (0.48) SLC22A12ESRRAARTTREPAS1
SCHEMBL14656177 0.88 SLC22A12 (0.48) SLC22A12ESRRAARTTREPAS1
SCHEMBL14656239 0.87 SLC22A12 (0.47) SLC22A12ESRRAARTTR
SCHEMBL14656131 0.85 SLC22A12 (0.51) SLC22A12ESRRAARHTR2ASLC6A4
SCHEMBL9889474 0.85 PLA2G7 (0.51) SLC22A12ESRRAARTTRHTR2A
SCHEMBL17302908 0.82 SLC22A12 (0.40) SLC22A12ESRRAAREPAS1
SCHEMBL875640 0.82 AR (0.57) SLC22A12ESRRAAR
SCHEMBL14656413 0.82 SLC22A12 (0.48) SLC22A12ARTTREPAS1
SCHEMBL14656186 0.82 SLC22A12 (0.51) SLC22A12ESRRAARHTR2ASLC6A4
SCHEMBL14662061 0.82 AR (0.44) SLC22A12ESRRAARTTREPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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
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 (3 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-20120142717-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 SLC22A12 1907/4885ESRRA 3666/4885AR 4068/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B SLC22A12 2438/4885ESRRA 3825/4885AR 3287/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B SLC22A12 2505/4885ESRRA 3737/4885AR 3324/4885

“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.