SCHEMBL8409296

SCHEMBL8409296

O=C(OCCOc1c(Cl)cc(O)cc1Cl)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TDP1 Q9NUW8 3/20 0.51
ESR1 P03372 2/20 0.50
ESR2 Q92731 1/20 0.50
KMT2A Q03164 3/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A3 Q01959 1/20 0.46
PLAU P00749 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 4/20 0.44
PKM P14618 3/20 0.44
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
CHRM1 P11229 1/20 0.44
KDR P35968 1/20 0.44
HIF1A Q16665 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42

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
SCHEMBL8657702 0.93 TDP1 (0.63) LMNATDP1ESR1ESR2KMT2A
SCHEMBL8658023 0.93 TDP1 (0.58) LMNATDP1ESR1ESR2KMT2A
SCHEMBL14089605 0.81 LMNA (0.46) LMNATDP1ESR1ESR2KMT2A
SCHEMBL8405675 0.80 ALDH1A1 (0.51) TDP1PLAUL3MBTL1MAPK1ALDH1A1
SCHEMBL7073708 0.79 TDP1 (0.55) LMNATDP1ESR1KMT2ASLC6A2
SCHEMBL7073022 0.79 L3MBTL1 (0.51) LMNATDP1ESR1KMT2ASLC6A2
SCHEMBL7078180 0.79 TDP1 (0.51) LMNATDP1ESR1ESR2KMT2A
SCHEMBL8408253 0.79 HRH3 (0.51) LMNATDP1ESR1ESR2KMT2A
SCHEMBL8655135 0.79 TDP1 (0.41) LMNATDP1ESR1ESR2KMT2A
SCHEMBL8405334 0.78 ALDH1A1 (0.47) KMT2APLAUL3MBTL1PKMALDH1A1

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