SCHEMBL9492691

SCHEMBL9492691

FC(F)(F)Oc1ccc(C(=CC=Cc2cccc(Oc3ccccc3)c2)C(F)(F)Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.41
CETP P11597 4/20 0.39
TLR4 O00206 1/20 0.38
TLR2 O60603 1/20 0.38
ALOX5 P09917 3/20 0.38
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
EPOR P19235 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
EPHX2 P34913 2/20 0.36
FAAH O00519 1/20 0.36
ALOX5AP P20292 1/20 0.36
LTA4H P09960 1/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
GRK2 P25098 1/20 0.34

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
SCHEMBL9492684 1.00 MAPK14 (0.41) MAPK14CETPTLR4TLR2ALOX5
SCHEMBL10446782 0.94 MEN1 (0.40) MAPK14CETPTLR4TLR2ALOX5
SCHEMBL9492710 0.93 MAPK14 (0.42) MAPK14CETPTLR4TLR2ALOX5
SCHEMBL9492708 0.93 MAPK14 (0.42) MAPK14CETPTLR4TLR2ALOX5
SCHEMBL9493704 0.88 ALDH1A1 (0.38) MAPK14CETPALOX5EPHX2FAAH
SCHEMBL9493701 0.88 ALDH1A1 (0.38) MAPK14CETPALOX5EPHX2FAAH
SCHEMBL9493136 0.86 LTA4H (0.44) CETPALOX5PTGS1PTGS2EPOR
SCHEMBL9493140 0.86 LTA4H (0.44) CETPALOX5PTGS1PTGS2EPOR
SCHEMBL9491929 0.85 PARP10 (0.34) MAPK14MEN1KMT2AEPHX2FAAH
SCHEMBL9491927 0.85 PARP10 (0.34) MAPK14MEN1KMT2AEPHX2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240121-B1 DIPHENYL ETHER DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-17 EP claimed
EP-0279531-B1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF INSECTICIDALLY ACTIVE COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-10 EP disclosed
US-5081273-A PROCESS FOR THE PREPARATION OF INSECTICIDALLY ACTIVE DIPHENYL ETHER COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-01-14 US disclosed
EP-0240121-B1 DIPHENYL ETHER DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-17 EP disclosed
EP-0390228-A2 Chemical intermediates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-10-03 EP disclosed
US-4942264-A WITTIG REACTION FOLLOWED BY REDUCTION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-07-17 US disclosed
US-4791139-A Diphenyl ether derivatives and their use as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-13 US disclosed
EP-0240121-A2 Diphenyl ether derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-10-07 EP disclosed