SCHEMBL8409129

SCHEMBL8409129

COc1ccc(COc2ccc(COc3c(O)cc(Cl)cc3Cl)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.53
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAOB P27338 3/20 0.48
MAOA P21397 2/20 0.46
FFAR1 O14842 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
ACLY P53396 1/20 0.43
PLA2G4B P0C869 1/20 0.43

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
SCHEMBL8408576 0.87 LMNA (0.54) MAOBFFAR1MAPTACLY
SCHEMBL8405686 0.83 CCR5 (0.48) APPMAOBMAOAMAPTFNTA
SCHEMBL8409305 0.82 CALM1 (0.50) APPNPC1RAB9APOLBSMN1; SMN2
SCHEMBL8405497 0.80 MEN1 (0.47) APPMAOBMAOAMAPT
SCHEMBL31662278 0.78 APP (0.51) APPNPC1RAB9APOLBSMN1; SMN2
SCHEMBL9618281 0.77 APP (0.67) APPNPC1RAB9APOLBSMN1; SMN2
SCHEMBL13424151 0.75 APP (0.69) APPNPC1RAB9APOLBSMN1; SMN2
SCHEMBL20000873 0.74 APP (0.80) APPNPC1RAB9APOLBSMN1; SMN2
SCHEMBL3413491 0.73 MAOB (0.55) NPC1RAB9APOLBSMN1; SMN2MAOB
SCHEMBL3613914 0.72 ALDH1A1 (0.53) APPNPC1RAB9APOLBSMN1; 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