SCHEMBL19225261

SCHEMBL19225261

CN1c2cc(OCc3ccc(Cl)c(F)c3)nc(=N)n2CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 15/20 0.37
SIGMAR1 Q99720 2/20 0.35
DRD4 P21917 1/20 0.35
MAOB P27338 1/20 0.33
F9 P00740 1/20 0.33
F10 P00742 1/20 0.33
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33

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
SCHEMBL19225412 0.91 MAOA (0.34) PLA2G7SIGMAR1DRD4MAOBF9
SCHEMBL15901188 0.88 PLA2G7 (0.44) PLA2G7MAOB
SCHEMBL19225227 0.86 PLA2G7 (0.32) PLA2G7MAOB
SCHEMBL15900990 0.80 PLA2G7 (0.42) PLA2G7
SCHEMBL16775593 0.78 GRM5 (0.39) PLA2G7MAOB
SCHEMBL15901142 0.73 PLA2G7 (0.39) PLA2G7
SCHEMBL15920489 0.72 PLA2G7 (0.43) PLA2G7
SCHEMBL15901311 0.72 PLA2G7 (0.49) PLA2G7
SCHEMBL15900997 0.72 PLA2G7 (0.49) PLA2G7
SCHEMBL14670123 0.72 PLA2G7 (0.48) PLA2G7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948452-B1 2,3-DIHYDROIMIDAZOL[1,2-C]PYRIMIDIN-5(1H)-ONE BASED LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 (LP-PLA2) INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2017-08-09 EP disclosed