SCHEMBL8408574

SCHEMBL8408574

Oc1cc(Cl)c(OCc2ccc(OCc3ccccc3)cc2)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
PTGS1 P23219 1/20 0.61
SLC6A2 P23975 1/20 0.61
CYP2C19 P33261 1/20 0.61
PTGS2 P35354 1/20 0.61
SLC6A3 Q01959 1/20 0.61
HIF1A Q16665 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
MAOB P27338 4/20 0.51
BCHE P06276 2/20 0.51
LTA4H P09960 1/20 0.51
EPHX2 P34913 1/20 0.51
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
FFAR1 O14842 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50

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
SCHEMBL8405763 0.92 LMNA (0.50) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8405445 0.89 FFAR1 (0.49) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8408376 0.88 CYP4F2 (0.56) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8405859 0.85 GSTP1 (0.46) LMNAGAAMAPTFFAR1TP53
SCHEMBL8408576 0.85 LMNA (0.54) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8405555 0.84 LTA4H (0.47) LMNAMAOBLTA4HGAAMAPT
SCHEMBL8409305 0.82 CALM1 (0.50) LMNACYP1A2CYP2C19MAOBFFAR1
SCHEMBL8408899 0.82 LTA4H (0.50) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8408730 0.81 MAPT (0.51) MAOBMAPTNR4A2MAOA
SCHEMBL8405791 0.81 RAB9A (0.48) CYP1A2SLC6A2SLC6A3MAPTRAB9A

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