SCHEMBL8657406

SCHEMBL8657406

ClC(Cl)=CCOc1cc(Br)c(OCCCCc2ccccc2)c(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 2/20 0.43
FFAR1 O14842 2/20 0.40
THRA P10827 4/20 0.39
THRB P10828 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PLA2G4B P0C869 1/20 0.36
NAAA Q02083 1/20 0.36
S1PR1 P21453 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL8658506 0.89 IGF1R (0.38) RHEBTHRATHRBMEN1KMT2A
SCHEMBL8405678 0.87 S1PR1 (0.41) FFAR1MEN1KMT2ANPY1RNPY2R
SCHEMBL8658519 0.86 S1PR1 (0.41) FFAR1TDP1L3MBTL1PLA2G4BNAAA
SCHEMBL8661920 0.86 S1PR1 (0.41) FFAR1TDP1L3MBTL1PLA2G4BNAAA
SCHEMBL8660296 0.83 HPGD (0.39) RHEBFFAR1MEN1KMT2ANPY1R
SCHEMBL8405448 0.82 KLK1 (0.41) THRATHRBMEN1KMT2APOLB
SCHEMBL8659576 0.82 MRGPRX4 (0.38) FFAR1MEN1KMT2ANPY1RNPY2R
SCHEMBL8658642 0.82 PPARD (0.41) RHEBFFAR1MAOAMAOB
SCHEMBL8405537 0.81 KLK1 (0.40) THRATHRBMEN1KMT2ATDP1
SCHEMBL8405833 0.81 KLK1 (0.38) THRATHRBMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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