SCHEMBL8408780

SCHEMBL8408780

Cc1cc(OCC=C(Br)Br)cc(C)c1OCCCCCl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
MAPK1 P28482 2/20 0.34
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 3/20 0.32
ATM Q13315 1/20 0.32
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
MCL1 Q07820 1/20 0.32
CYP3A4 P08684 1/20 0.31
KCNH2 Q12809 1/20 0.31
CACNA1C Q13936 1/20 0.31
SCN5A Q14524 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
SCHEMBL8409409 0.95 KDM4E (0.37) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8409215 0.92 KDM4E (0.41) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8409064 0.90 KDM4E (0.34) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8409029 0.88 KDM4E (0.39) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8405428 0.88 KDM4E (0.39) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8555058 0.87 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL7979192 0.87 KDM4E (0.38) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8405628 0.87 HTT (0.38) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8405318 0.87 KDM4E (0.37) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8408748 0.87 KDM4E (0.37) MEN1KMT2AKDM4EALDH1A1CYP1A2

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