SCHEMBL8409137

SCHEMBL8409137

BrCCCOc1c(Br)cc(OCC=C(Br)Br)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KLK1 P06870 1/20 0.37
HRH3 Q9Y5N1 3/20 0.36
THRA P10827 5/20 0.34
THRB P10828 5/20 0.34
KDM4E B2RXH2 2/20 0.32
PLAU P00749 1/20 0.32
ALDH1A1 P00352 3/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8408920 0.95 KLK1 (0.43) KLK1HRH3THRATHRBKDM4E
SCHEMBL8408455 0.93 KDM4E (0.39) KLK1HRH3THRATHRBKDM4E
SCHEMBL8408791 0.89 KLK1 (0.38) KLK1HRH3THRATHRBKDM4E
SCHEMBL8407912 0.89 KLK1 (0.38) KLK1HRH3THRATHRBKDM4E
SCHEMBL8405839 0.88 KLK1 (0.37) KLK1HRH3THRATHRBKDM4E
SCHEMBL8408377 0.88 KLK1 (0.41) KLK1HRH3THRATHRBKDM4E
SCHEMBL8407580 0.88 KLK1 (0.37) KLK1HRH3THRATHRBKDM4E
SCHEMBL8405412 0.86 PLAU (0.33) KDM4EPLAUHPGD
SCHEMBL8405765 0.86 KLK1 (0.40) KLK1HRH3THRATHRBKDM4E
SCHEMBL7979639 0.86 KLK1 (0.40) KLK1HRH3THRATHRBKDM4E

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