SCHEMBL9804207

SCHEMBL9804207

O=[PH](OCC=Cc1ccc(F)c(Oc2ccccc2)c1)OCC=Cc1ccc(F)c(Oc2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.38
▸ EPOR P19235 3/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ BACE1 P56817 3/20 0.36
▸ ALOX5 P09917 1/20 0.35
▸ ALOX5AP P20292 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ PTPN1 P18031 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
SCHEMBL10446491 1.00 TTR (0.38) TTREPORHRH1BACE1ALOX5
SCHEMBL10446493 0.90 EPOR (0.38) TTREPORHRH1BACE1ALOX5
SCHEMBL9804304 0.80 ALDH1A1 (0.42) TTREPORHRH1BACE1ALOX5
SCHEMBL29110079 0.80 EPOR (0.40) TTREPORHRH1BACE1ALOX5
SCHEMBL9496444 0.80 TTR (0.39) TTREPORHRH1BACE1ALOX5
SCHEMBL9496431 0.80 TTR (0.39) TTREPORHRH1BACE1ALOX5
SCHEMBL29110082 0.80 EPOR (0.40) TTREPORHRH1BACE1ALOX5
SCHEMBL9492703 0.77 TTR (0.40) TTREPORBACE1ALOX5ALOX5AP
SCHEMBL29110085 0.75 ALDH1A1 (0.50) TTRALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL10489447 0.75 ALDH1A1 (0.50) TTRALDH1A1MAPTMAPK1L3MBTL1

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-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-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
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