SCHEMBL9901003

SCHEMBL9901003

Fc1ccc(Oc2ccc(COc3nc(Cl)ncc3Cl)cc2F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.41
CNR1 P21554 9/20 0.39
CNR2 P34972 2/20 0.38
MAPK14 Q16539 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
POLB P06746 1/20 0.37
CASP6 P55212 1/20 0.37
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HTR2A P28223 3/20 0.35
SLC6A4 P31645 3/20 0.35
KCNH2 Q12809 3/20 0.35
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL9900548 0.89 MAOA (0.39) PLA2G7CNR1CNR2MAPK14MAOA
SCHEMBL15277240 0.89 CNR1 (0.40) PLA2G7CNR1CNR2MAPK14MAOA
SCHEMBL9901634 0.81 POLB (0.41) PLA2G7MAPK14POLBCASP6ALDH1A1
SCHEMBL9900951 0.81 PLA2G7 (0.41) PLA2G7CNR1CNR2MAPK14MAOA
SCHEMBL15262648 0.77 CNR1 (0.45) PLA2G7CNR1CNR2ALDH1A1
SCHEMBL9905066 0.74 P2RX7 (0.41) PLA2G7
SCHEMBL15262237 0.74 PLA2G7 (0.42) PLA2G7CNR1MAPK14
SCHEMBL9905081 0.72 MAOB (0.40) PLA2G7MAOAMAOB
SCHEMBL30792322 0.72 MAOB (0.50) CNR1MAPK14MAOAMAOB
SCHEMBL29918426 0.69 TTR (0.46) MAOAMAOBHTR2ASLC6A4

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 PLA2G7 6/4885CNR1 1212/4885CNR2 920/4885

“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.