SCHEMBL8405459

SCHEMBL8405459

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.35
TP53 P04637 2/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 2/20 0.34
CYP3A4 P08684 2/20 0.34
KCNH2 Q12809 1/20 0.34
CACNA1C Q13936 1/20 0.34
SCN5A Q14524 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
MCL1 Q07820 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 3/20 0.32
CYP2D6 P10635 3/20 0.32
MEN1 O00255 2/20 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
SCHEMBL8405610 0.96 KDM4E (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8405628 0.92 HTT (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8408745 0.91 TP53 (0.39) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8405615 0.90 HTT (0.36) KDM4EHTTMAPK1CYP3A4MAPT
SCHEMBL7978953 0.90 KDM4E (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8407281 0.90 KDM4E (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8410067 0.89 TP53 (0.37) KDM4EALDH1A1HTTTP53MAPK1
Hydrochloric Acid SCHEMBL6549831 0.88 KDM4E (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL7982136 0.88 KDM4E (0.38) KDM4EALDH1A1HTTTP53MAPK1
SCHEMBL8407866 0.88 KDM4E (0.36) KDM4EALDH1A1HTTTP53MAPK1

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