SCHEMBL8405799

SCHEMBL8405799

CCc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCO

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
THRB P10828 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 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
SCHEMBL8408696 0.96 HTT (0.36) HTTL3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL8408496 0.92 HTT (0.40) HTTL3MBTL1KDM4EALDH1A1GAA
SCHEMBL8408644 0.91 HTT (0.37) HTTL3MBTL1KDM4EALDH1A1THRB
SCHEMBL8408548 0.90 HTT (0.36) HTTL3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL8408691 0.89 HTT (0.36) HTTL3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL8564449 0.88 HTT (0.39) HTTL3MBTL1KDM4EALDH1A1THRB
SCHEMBL2345060 0.88 HTT (0.36) HTTL3MBTL1MAPTHPGD
SCHEMBL8407349 0.88 HTT (0.35) HTTL3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL8409335 0.87 HTT (0.36) HTTKDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL8408474 0.85 L3MBTL1 (0.34) L3MBTL1KDM4EALDH1A1CYP1A2CYP2D6

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