SCHEMBL6091606

SCHEMBL6091606

COc1ccc(-c2cnc3ccccc3c2)cc1CC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.56
PDGFRA P16234 4/20 0.56
PTGDR2 Q9Y5Y4 1/20 0.49
MAP4K4 O95819 2/20 0.46
CSNK1G2 P78368 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
MAP4K5 Q9Y4K4 1/20 0.46
PIK3CD O00329 1/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
MTOR P42345 1/20 0.46
PIK3CG P48736 1/20 0.46
MGAM O43451 1/20 0.45
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARD Q03181 3/20 0.43

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
SCHEMBL6092281 0.91 ALPL (0.50) PDGFRBPDGFRAPTGDR2MAP4K4CSNK1G2
SCHEMBL6094174 0.78 PDGFRB (0.55) PDGFRBPDGFRAPTGDR2MAP4K4CSNK1G2
SCHEMBL6093061 0.78 MKNK1 (0.56) MKNK2PPARDLTB4RPPARGPPARA
SCHEMBL8109340 0.78 MGAM (0.68) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL6091040 0.76 TNFRSF1A (0.53) L3MBTL1LTB4RMEN1NPC1RAB9A
SCHEMBL29377512 0.74 PIK3CD (0.73) PDGFRBPDGFRAPIK3CDPIK3CAPIK3CB
SCHEMBL6091799 0.73 CHEK2 (0.43) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL6091940 0.73 TNFRSF1A (0.52) L3MBTL1MEN1KMT2A
SCHEMBL8172493 0.72 PDGFRB (1.00) PDGFRBPDGFRA
SCHEMBL6092630 0.70 PIK3CD (0.58) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ATHEROGENICS, INC. 2006-03-23 US disclosed
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 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-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ABCB11, CEL, CYP46A1 PDGFRB 929/4885PDGFRA 965/4885PTGDR2 572/4885

“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.