SCHEMBL7965820

SCHEMBL7965820

CN(CCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.33
CYP11B2 P19099 3/20 0.33
NR1H2 P55055 3/20 0.32
NR1H3 Q13133 3/20 0.32
CACNA1B Q00975 2/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
KCNH2 Q12809 1/20 0.32
PPARD Q03181 1/20 0.31
HTT P42858 1/20 0.31
CACNA1H O95180 1/20 0.31
PDK2 Q15119 2/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
THRB P10828 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
GSTP1 P09211 1/20 0.30

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
SCHEMBL7979491 0.97 CYP11B1 (0.32) CYP11B1CYP11B2NR1H2NR1H3CACNA1B
SCHEMBL8408473 0.86 HTT (0.35) CYP11B1CYP11B2NR1H2NR1H3PTGDR2
SCHEMBL8657724 0.86 KDM4E (0.37) KDM4EHTT
SCHEMBL7965823 0.84 BCHE (0.46) CYP11B1CYP11B2KDM4EPPARDPDK2
SCHEMBL7977839 0.84 APP (0.33) NR1H2NR1H3PTGDR2
SCHEMBL8405535 0.83 PPARA (0.39) PPARDHTTTHRB
SCHEMBL8405597 0.83 MAOB (0.39) PPARDHTTMRGPRX4THRB
SCHEMBL8405534 0.82 NR1H2 (0.36) NR1H2NR1H3CACNA1BPTGDR2KDM4E
SCHEMBL8659996 0.81 FFAR1 (0.36) KCNH2PPARDTHRB
SCHEMBL7979492 0.81 BCHE (0.43) CYP11B1CYP11B2KDM4EPPARDPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
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