SCHEMBL8657146

SCHEMBL8657146

ClC(Cl)=CCOc1cc(Cl)c(OCC=CCOc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
MAOB P27338 1/20 0.34
HPGD P15428 1/20 0.32
AOC3 Q16853 1/20 0.32
PTGS2 P35354 1/20 0.31
NR4A2 P43354 2/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL8657142 1.00 HTT (0.43) HTTMAOBHPGDAOC3PTGS2
SCHEMBL8661330 1.00 HTT (0.43) HTTMAOBHPGDAOC3PTGS2
SCHEMBL8407941 0.89 HTT (0.43) HTTMAOB
SCHEMBL8405697 0.87 HTT (0.42) HTT
SCHEMBL8408726 0.87 HTT (0.42) HTTMAOBHPGDRAB9ANPSR1
SCHEMBL8407690 0.86 HTT (0.41) HTT
SCHEMBL7631130 0.85 HTT (0.35) HTT
SCHEMBL7631133 0.85 HTT (0.35) HTT
SCHEMBL8635753 0.85 HTT (0.38) HTTMAOBPTGS2
SCHEMBL8659976 0.84 HTT (0.36) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed