SCHEMBL8022339

SCHEMBL8022339

[CH2]CCCCCOc1c(CC)cc(OCC=C(Cl)Cl)cc1CC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
PLA2G2A P14555 1/20 0.32
THRA P10827 2/20 0.32
THRB P10828 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL8011722 0.99 HTT (0.38) HTTPLA2G2ATHRATHRBL3MBTL1
SCHEMBL8022028 0.95 HTT (0.39) HTTL3MBTL1KDM4EALDH1A1GAA
SCHEMBL7631862 0.88 HTT (0.38) HTTPLA2G2ATHRATHRBL3MBTL1
SCHEMBL8659755 0.88 HTT (0.40) HTTPLA2G2ATHRATHRBL3MBTL1
SCHEMBL8564449 0.86 HTT (0.39) HTTPLA2G2ATHRATHRBL3MBTL1
SCHEMBL7627660 0.86 HTT (0.39) HTTPLA2G2ATHRATHRBL3MBTL1
SCHEMBL8407296 0.86 HTT (0.40) HTTTHRATHRBL3MBTL1KDM4E
SCHEMBL6548674 0.86 HTT (0.36) HTTPLA2G2ATHRATHRBL3MBTL1
Hydrochloric Acid SCHEMBL6548748 0.86 HTT (0.36) HTTPLA2G2ATHRATHRBL3MBTL1
Hydrochloric Acid SCHEMBL6550001 0.86 HTT (0.36) HTTPLA2G2ATHRATHRBL3MBTL1

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
EP-0975586-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION Sumitomo Chemical Company, Limited (JP) 2000-02-02 EP disclosed
WO-1998045254-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-15 WO disclosed