SCHEMBL8409203

SCHEMBL8409203

Cc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCCOc1ccc(Br)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
TP53 P04637 2/20 0.36
GAA P10253 1/20 0.36
DRD4 P21917 3/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
KDM4E B2RXH2 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
PPARD Q03181 3/20 0.35
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPK1 P28482 1/20 0.33
MCL1 Q07820 1/20 0.33

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
SCHEMBL8659679 0.98 HTT (0.39) HTTTP53GAADRD4DRD2
SCHEMBL8405656 0.92 HTT (0.40) HTTDRD4DRD2DRD3KDM4E
SCHEMBL8408870 0.91 HTT (0.40) HTTTP53GAADRD4DRD2
SCHEMBL8405387 0.89 HTT (0.40) HTTDRD4DRD2DRD3KDM4E
SCHEMBL8659512 0.88 HTT (0.40) HTTTP53GAADRD4DRD2
SCHEMBL8657194 0.87 PPARD (0.37) HTTKDM4EMEN1KMT2APPARD
SCHEMBL8659960 0.86 HTT (0.38) HTTTP53GAADRD4DRD2
SCHEMBL8655716 0.86 HTT (0.40) HTTDRD4DRD2DRD3KDM4E
SCHEMBL8407281 0.85 KDM4E (0.38) HTTTP53GAAKDM4EMEN1
SCHEMBL8659923 0.85 PPARD (0.40) HTTTP53GAACYP3A4PPARD

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