SCHEMBL8407941

SCHEMBL8407941

ClC(Cl)=CCOc1cc(Cl)c(OCCOc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
MAOB P27338 4/20 0.38
MAOA P21397 1/20 0.37
ALDH1A1 P00352 1/20 0.34
DRD4 P21917 2/20 0.34
KCNH2 Q12809 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
GPR84 Q9NQS5 1/20 0.34
ORAI1 Q96D31 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PPARA Q07869 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH3A1 P30838 1/20 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
SCHEMBL8405697 0.96 HTT (0.42) HTTALDH1A1DRD4KCNH2DRD2
SCHEMBL8408726 0.96 HTT (0.42) HTTMAOBALDH1A1DRD4KCNH2
SCHEMBL8909747 0.89 HTT (0.41) HTTALDH1A1TDP1
SCHEMBL8657700 0.89 HTT (0.40) HTTALDH1A1DRD4DRD2DRD3
SCHEMBL8657142 0.89 HTT (0.43) HTTMAOB
SCHEMBL8657146 0.89 HTT (0.43) HTTMAOB
SCHEMBL8661330 0.89 HTT (0.43) HTTMAOB
SCHEMBL8659512 0.87 HTT (0.40) HTTALDH1A1DRD4KCNH2DRD2
SCHEMBL8408870 0.87 HTT (0.40) HTTALDH1A1DRD4KCNH2DRD2
SCHEMBL6550042 0.87 HTT (0.42) HTTALDH1A1ORAI1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US disclosed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP disclosed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO disclosed