SCHEMBL8405740

SCHEMBL8405740

Oc1cc(Cl)c(OCc2cc(Oc3ccc(F)cc3)ccc2F)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CACNA1C Q13936 1/20 0.39
HSP90AA1 P07900 1/20 0.39
FDFT1 P37268 2/20 0.38
HTR2A P28223 2/20 0.37
SLC6A4 P31645 2/20 0.37
KCNH2 Q12809 2/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
PPARA Q07869 5/20 0.37
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.36
SOS1 Q07889 1/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
THRA P10827 2/20 0.35
THRB P10828 2/20 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
SCHEMBL27540591 0.84 CACNA1C (0.44) CACNA1CHSP90AA1FDFT1HTR2ASLC6A4
SCHEMBL8409024 0.83 HTR2A (0.34) CACNA1CFDFT1HTR2ASLC6A4KCNH2
SCHEMBL8408818 0.80 FFAR1 (0.44) MRGPRX4PPARAPPARDMAPTRAB9A
SCHEMBL11326273 0.76 FDFT1 (0.46) CACNA1CFDFT1PPARAPPARGPPARD
SCHEMBL8405595 0.75 MAPT (0.50) NPC1GAAMAPTRAB9ATHRB
SCHEMBL8408641 0.75 LTA4H (0.40) HSP90AA1NPC1RAB9ATHRATHRB
SCHEMBL8407193 0.75 MAPT (0.47) MAPT
SCHEMBL8405716 0.74 POLB (0.48) KCNH2PPARAPPARGPPARDNPC1
SCHEMBL8405497 0.73 MEN1 (0.47) MAPT
SCHEMBL8405973 0.71 PPARG (0.47) MRGPRX4PPARAPPARG

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