SCHEMBL9900951

SCHEMBL9900951

O=c1nc(OCc2ccc(Oc3ccc(F)c(F)c3)c(F)c2)c(Cl)c[nH]1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.41
MAPK14 Q16539 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
CNR1 P21554 10/20 0.37
CNR2 P34972 2/20 0.36
TRPA1 O75762 1/20 0.36
P2RX3 P56373 2/20 0.35
ACHE P22303 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
SCN9A Q15858 1/20 0.34

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
SCHEMBL9905081 0.88 MAOB (0.40) PLA2G7MAOAMAOBTRPA1ACHE
SCHEMBL15263042 0.87 SCN9A (0.39) CNR1CNR2TRPA1SCN9A
SCHEMBL9901003 0.81 PLA2G7 (0.41) PLA2G7MAPK14MAOAMAOBCNR1
SCHEMBL9904872 0.80 TRPA1 (0.34) MAOBTRPA1P2RX3
SCHEMBL15277240 0.79 CNR1 (0.40) PLA2G7MAPK14MAOAMAOBCNR1
SCHEMBL9904993 0.77 SLC22A12 (0.41) PLA2G7CNR1CNR2
SCHEMBL9900548 0.74 MAOA (0.39) PLA2G7MAPK14MAOAMAOBCNR1
SCHEMBL9905066 0.73 P2RX7 (0.41) PLA2G7
SCHEMBL15262237 0.73 PLA2G7 (0.42) PLA2G7MAPK14CNR1P2RX3
SCHEMBL15266768 0.70 CSF1R (0.38) PLA2G7MAOAMAOBP2RX3ACHE

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 4 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
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
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 PLA2G7 6/4885MAPK14 1525/4885MAOA 765/4885

“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.