SCHEMBL7638009

SCHEMBL7638009

CC(Cl)=CCOCCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PLAU P00749 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
SCHEMBL7638008 1.00 HTT (0.38) HTTMAPTHPGDMAPK1L3MBTL1
SCHEMBL7635389 0.94 HTT (0.35) HTTMAPTHPGDMAPK1L3MBTL1
SCHEMBL7638014 0.93 HTT (0.37) HTTMAPTHPGD
SCHEMBL7631827 0.93 HTT (0.35) HTTPLAU
SCHEMBL7635749 0.93 HTT (0.35) HTTPLAU
SCHEMBL7630354 0.92 HTT (0.35) HTTMAPTHPGDMAPK1L3MBTL1
SCHEMBL7629749 0.91 HTT (0.37) HTTMAPTHPGDMAPK1L3MBTL1
SCHEMBL8656855 0.89 HTT (0.43) HTTMAPTSMN1; SMN2
SCHEMBL8656857 0.89 HTT (0.43) HTTMAPTSMN1; SMN2
SCHEMBL8408754 0.89 HTT (0.39) HTTMAPTHPGDMAPK1L3MBTL1

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