SCHEMBL7629683

SCHEMBL7629683

CCCCOC(COCCCCOc1c(CC)cc(OCC=C(Cl)Cl)cc1CC)OCCCC

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
PLA2G2A P14555 3/20 0.31
PLA2G10 O15496 1/20 0.31
PLA2G1B P04054 1/20 0.31
PLA2G5 P39877 1/20 0.31
PLA2G4B P0C869 1/20 0.31
LPAR1 Q92633 2/20 0.30
LPAR3 Q9UBY5 2/20 0.30
THRA P10827 2/20 0.30
THRB P10828 2/20 0.30
CNR2 P34972 2/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL7630791 0.99 HTT (0.34) HTTPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL7631847 0.94 HTT (0.33) HTT
SCHEMBL7631224 0.94 HTT (0.32) HTTPLA2G2APLA2G4BTHRATHRB
SCHEMBL7637259 0.94 HTT (0.32) HTT
SCHEMBL6548633 0.91 HTT (0.33) HTT
SCHEMBL7630303 0.90 HTT (0.33) HTT
SCHEMBL7636662 0.89 HTT (0.31) HTT
SCHEMBL7631115 0.88 HTT (0.33) HTTTHRATHRB
SCHEMBL7629913 0.88 HTT (0.34) HTT
SCHEMBL7634583 0.88 THRA (0.30) HTTPLA2G2ATHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888270-B1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2002-04-17 EP disclosed
EP-0888270-A1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-01-07 EP disclosed
WO-1997028112-A1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-07 WO disclosed