SCHEMBL8407162

SCHEMBL8407162

ClC(Cl)=CCOc1cc(Cl)c(OCc2c(Cl)cccc2Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 5/20 0.38
TDP1 Q9NUW8 2/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
MET P08581 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGER1 P34995 3/20 0.33
PTGER4 P35408 3/20 0.33
PTGER3 P43115 3/20 0.33
PTGER2 P43116 3/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32

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
SCHEMBL8405491 0.84 NR4A2 (0.43) SMN1; SMN2KMT2AMAPTHTTNPSR1
SCHEMBL8407690 0.83 HTT (0.41) HTT
SCHEMBL8408601 0.83 KDM4E (0.41) SMN1; SMN2KMT2AMAPTALDH1A1NPSR1
SCHEMBL8408480 0.82 MAOB (0.46) KMT2AMAPTNPSR1CYP1A2CYP2C19
SCHEMBL15382958 0.81 SMN1; SMN2 (0.41) SMN1; SMN2KMT2AALDH1A1NPSR1POLB
SCHEMBL7075719 0.81 PPARG (0.39) SMN1; SMN2TDP1ALDH1A1HTTLMNA
SCHEMBL8405986 0.80 MAOB (0.44)
SCHEMBL8407936 0.80 MAOB (0.44)
SCHEMBL8405543 0.80 MAOB (0.48)
SCHEMBL8405583 0.80 MAPT (0.45) KMT2AMAPTNPSR1CYP1A2CYP2C19

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