SCHEMBL8636074

SCHEMBL8636074

FC(F)(F)COc1ccc(Oc2ccc(OCC=C(Cl)Cl)c(C(F)(F)F)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 4/20 0.37
AR P10275 3/20 0.36
HTT P42858 2/20 0.36
CYP2C9 P11712 2/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
SCN8A Q9UQD0 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPARA Q07869 1/20 0.32
S1PR1 P21453 1/20 0.32

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
SCHEMBL8635048 0.89 MAPT (0.44) KDM4EALDH1A1ARHTTSMN1; SMN2
SCHEMBL8636474 0.89 RXRA (0.38) ARRAB9AMAPT
SCHEMBL8634174 0.89 AR (0.39) ARPPARA
SCHEMBL8633864 0.88 MAOB (0.36) ARHTTPPARA
SCHEMBL8632656 0.88 KDM4E (0.37) KDM4EALDH1A1ARCYP2C9CYP1A2
SCHEMBL8633073 0.88 L3MBTL1 (0.39) KDM4EALDH1A1ARHTTSMN1; SMN2
SCHEMBL8635558 0.87 LTA4H (0.43) ARHTTSCN8ASCN10AMAPT
SCHEMBL8635519 0.87 LTA4H (0.43) HTTPPARAS1PR1
SCHEMBL8638861 0.86 AR (0.38) KDM4EALDH1A1ARSMN1; SMN2MEN1
SCHEMBL8636008 0.85 AR (0.38) ARS1PR1

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
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed