SCHEMBL9900759

SCHEMBL9900759

Oc1ncc(F)c(OCCc2ccc(Oc3ccccc3)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.43
LTA4H P09960 5/20 0.42
EPHX2 P34913 2/20 0.42
FFAR1 O14842 3/20 0.41
FAAH O00519 2/20 0.40
CES1 P23141 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
NCEH1 Q6PIU2 1/20 0.39
PLA2G2A P14555 1/20 0.38
FNTA P49354 1/20 0.38
PGGT1B P53609 1/20 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
SCHEMBL15277251 0.85 ELOVL1 (0.40)
SCHEMBL9900905 0.85 PIN1 (0.51) PPARGLTA4HEPHX2FFAR1FAAH
SCHEMBL15277247 0.84 CALM1 (0.42)
SCHEMBL15277248 0.83 FFAR1 (0.39) PPARGFFAR1
SCHEMBL15277249 0.82 PPARG (0.39) PPARGLTA4HEPHX2FFAR1FFAR4
SCHEMBL9900964 0.81 ALDH1A1 (0.43) PPARGLTA4HEPHX2FFAR1CES1
SCHEMBL15277252 0.81 BACE1 (0.35) FAAH
SCHEMBL9923530 0.80 PLA2G7 (0.50)
SCHEMBL15277243 0.79 LIPE (0.46)
SCHEMBL15277250 0.79 TAAR1 (0.41) PPARG

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
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-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-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
EP-2649050-A1 COMPOUNDS Glaxo Group Limited (GB) 2013-10-16 EP disclosed
US-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
US-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
US-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
WO-2012075917-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-06-14 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-20130252986-A1 COMPOUNDS LIPG, ENPP2, PLA2G1B PPARG 705/4885LTA4H 14/4885EPHX2 264/4885

“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.