SCHEMBL14656122

SCHEMBL14656122

Cc1ccc(Oc2ccc(CO)cc2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.52
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ NR1H2 P55055 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ CYP4F2 P78329 1/20 0.38
▸ CYP4A11 Q02928 1/20 0.38
▸ FFAR4 Q5NUL3 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PPARG P37231 2/20 0.37
▸ TTR P02766 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ MMP2 P08253 1/20 0.36
▸ MMP3 P08254 1/20 0.36
▸ MMP7 P09237 1/20 0.36
▸ MMP9 P14780 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ RHEB Q15382 1/20 0.36

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
SCHEMBL9107096 0.87 MRGPRX4 (0.41) LTA4HMRGPRX4CYP4F2CYP4A11FFAR4
SCHEMBL14667748 0.86 LTA4H (0.52) LTA4HNR1H2NR1H3CYP4F2CYP4A11
SCHEMBL22185418 0.84 SMN1; SMN2 (0.43) MRGPRX4FFAR4LMNAGFERKMT2A
SCHEMBL5125208 0.84 LTA4H (0.57) LTA4HCYP4F2CYP4A11FFAR4TTR
SCHEMBL9900458 0.83 MRGPRX4 (0.40) MRGPRX4FFAR4LMNAGFERKMT2A
SCHEMBL257919 0.80 TEAD4 (0.48) MRGPRX4LMNAGFERKMT2AL3MBTL1
SCHEMBL14661841 0.79 LTA4H (0.52) LTA4HNR1H2NR1H3PPARGTTR
SCHEMBL715391 0.79 CYP4F2 (0.46) MRGPRX4CYP4F2CYP4A11FFAR4KMT2A
SCHEMBL28061160 0.78 LTA4H (0.48) LTA4HFFAR4LMNAKMT2AL3MBTL1
SCHEMBL15075246 0.78 LTA4H (0.48) LTA4HMRGPRX4NR1H2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103827118-B Bicyclic pyrimidin ketone compound GLAXO GROUP LTD. (GB) 2016-03-09 — — CN disclosed
US-9273054-B2 Substituted pyrimido[1,6-a]pyrimidines as Lp-PLA2 inhibitors GLAXO GROUP LIMITED (GB) 2016-03-01 — — US disclosed
US-9273054-B2 Substituted pyrimido[1,6-a]pyrimidines as Lp-PLA2 inhibitors GLAXO GROUP LIMITED (GB) 2016-03-01 — — US disclosed
US-9273054-B2 Substituted pyrimido[1,6-a]pyrimidines as Lp-PLA2 inhibitors GLAXO GROUP LIMITED (GB) 2016-03-01 — — US disclosed
US-8859573-B2 Pyrimidinone and pyridinone compounds for use in the treatment of diseases or conditions mediated by Lp-PLA2 GLAXO GROUP LIMITED (GB) 2014-10-14 — — US disclosed
US-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-06-26 — — US disclosed
EP-2736908-A1 BICYCLIC PYRIMIDONE COMPOUNDS Glaxo Group Limited (GB) 2014-06-04 — — EP disclosed
US-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 — — US disclosed
US-20130030012-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 — — US disclosed
US-20130030012-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 — — US disclosed
US-20130030012-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 — — US disclosed
WO-2013014185-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 — — WO disclosed
WO-2013014185-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 — — 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 (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-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS PLA2G7, PLA2G4A, PLA2G1B LTA4H 24/4885MRGPRX4 822/4885NR1H2 1416/4885
US-20130030012-A1 COMPOUNDS LPCAT1, PLA2G7, PLAAT2 LTA4H 44/4885MRGPRX4 680/4885NR1H2 297/4885
US-20130252986-A1 COMPOUNDS LIPG, ENPP2, PLA2G1B LTA4H 14/4885MRGPRX4 771/4885NR1H2 535/4885

“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.

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