SCHEMBL9889706

SCHEMBL9889706

Cc1cccc(Oc2ccc(CCNc3nc(=O)c(Cc4nccs4)c[nH]3)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LYN P07948 1/20 0.37
FFAR1 O14842 3/20 0.35
LMNA P02545 1/20 0.34
SNCA P37840 1/20 0.33
FES P07332 1/20 0.33
FGFR1 P11362 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
CYP3A4 P08684 1/20 0.33
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
P2RX3 P56373 1/20 0.32
LTA4H P09960 2/20 0.32
PLA2G2A P14555 2/20 0.32
TTBK1 Q5TCY1 1/20 0.32
TTBK2 Q6IQ55 1/20 0.32
MMP14 P50281 1/20 0.32
HPGD P15428 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL9106932 0.88 AURKA (0.35) FFAR1LTA4HTTBK1TTBK2EPHX2
SCHEMBL9889712 0.88 CYP3A4 (0.33) FFAR1LMNACYP3A4P2RX3LTA4H
SCHEMBL9889705 0.86 P2RX3 (0.36) FESFGFR1FLT4KDRL3MBTL1
SCHEMBL9889718 0.83 LYN (0.39) LYNFFAR1LMNASNCAFES
SCHEMBL9889697 0.82 LYN (0.39) LYNFFAR1CYP3A4
SCHEMBL9105530 0.82 PLA2G7 (0.43) LYNFGFR1FLT4KDREPHX2
SCHEMBL9889711 0.73 MAPT (0.36) LMNAFESFGFR1FLT4KDR
SCHEMBL9889713 0.72 LMNA (0.35) FFAR1LMNACYP3A4P2RX3
SCHEMBL9889702 0.72 PLA2G7 (0.36) FFAR1LMNACYP3A4P2RX3
SCHEMBL9108510 0.72 CSF1R (0.37) L3MBTL1LTA4HTTBK1EPHX2

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 LYN 1908/4885FFAR1 386/4885LMNA 512/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B LYN 1934/4885FFAR1 514/4885LMNA 502/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B LYN 1989/4885FFAR1 508/4885LMNA 471/4885

“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.