SCHEMBL6548606

SCHEMBL6548606

ON=C(c1ccccc1)c1ccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.43
XBP1 P17861 1/20 0.43
PPARA Q07869 3/20 0.35
PPARG P37231 2/20 0.35
HTT P42858 2/20 0.34
PPARD Q03181 1/20 0.34
F2 P00734 1/20 0.33
PLG P00747 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
C1S P09871 1/20 0.33
PRSS3 P35030 1/20 0.33
DRD3 P35462 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 2/20 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
SCHEMBL6549758 0.98 MAPT (0.43) MAPTHPGDPOLBXBP1PPARA
SCHEMBL6548509 0.97 MAPT (0.42) MAPTHPGDPOLBXBP1PPARA
SCHEMBL6548348 0.88 ALDH1A1 (0.36) MAPTPPARAPPARGHTTPPARD
SCHEMBL6547658 0.87 PPARA (0.48) MAPTPPARAPPARGHTTPPARD
SCHEMBL3185522 0.86 HTT (0.37) MAPTHTTPRSS1L3MBTL1LMNA
SCHEMBL3185519 0.86 HTT (0.37) MAPTHTTPRSS1L3MBTL1LMNA
SCHEMBL8408702 0.86 KCNA3 (0.41) MAPTHPGDHTTF2PLG
SCHEMBL8022439 0.84 PPARA (0.51) MAPTPPARAPPARGHTTPPARD
SCHEMBL6548903 0.84 HTT (0.41) MAPTHPGDPOLBPPARAPPARG
SCHEMBL15382888 0.84 LTA4H (0.43) PPARAPPARGHTTPPARDDRD3

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-0975586-B1 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2004-12-01 EP claimed