SCHEMBL9364922

SCHEMBL9364922

FC1(F)C(Oc2ccccc2)=C(Oc2ccccc2)C(F)(F)C1(F)F

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.50
TSHR P16473 1/20 0.50
MAOA P21397 2/20 0.39
NR1H2 P55055 1/20 0.39
BAX Q07812 1/20 0.39
SRD5A2 P31213 1/20 0.36
MAOB P27338 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
GSTP1 P09211 1/20 0.33
SOS1 Q07889 1/20 0.33
CA9 Q16790 1/20 0.33
PARP10 Q53GL7 1/20 0.33

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
SCHEMBL30360063 0.90 LTA4H (0.55) LTA4HTSHRMAOANR1H2BAX
SCHEMBL9319286 0.86 LTA4H (0.41) LTA4HTSHRMAOANR1H2BAX
SCHEMBL9496291 0.79 HSPB1 (0.39) LTA4HKDM4EMAPTKMT2ASOS1
SCHEMBL29222726 0.77 LTA4H (0.46) LTA4HTSHRMAOANR1H2BAX
SCHEMBL9497883 0.77 ALDH1A1 (0.54) TSHRMAOAMAOBMAPTKMT2A
SCHEMBL9497570 0.77 MEN1 (0.54) LTA4HNR1H2BAXCA1CA2
SCHEMBL9500512 0.77 MAOA (0.45) LTA4HMAOAMAOBCA1CA2
SCHEMBL9498280 0.77 MAPT (0.45) LTA4HTSHRMAOASRD5A2MAOB
SCHEMBL9500535 0.76 MAOB (0.55) LTA4HTSHRMAOBMAPTKMT2A
SCHEMBL9496753 0.73 PARP15 (0.43) MAOBCA1CA2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0443370-B1 Dental materials BAYER AG (DE) 1994-08-24 EP claimed
US-5132335-A ACRYLIC AND METHACRYLIC ESTERS OF SUBSTITUTED 1,2-BIS(PHENOXY)-3,3,4,4,5,5-HEXAFLUORO-1-CYCLOPENTENES BAYER AKTIENGESELLSCHAFT (DE) 1992-07-21 US claimed
EP-0443370-A2 Dental materials BAYER AG (DE) 1991-08-28 EP claimed
JP-4211045-A None JP disclosed
EP-0443370-B1 Dental materials BAYER AG (DE) 1994-08-24 EP disclosed
EP-0343441-B1 FLUORINATED BIS-ARYLOXY-SUBSTITUTED ALKENES, METHOD FOR THEIR PRODUCTION AN THEIR APPLICATION BAYER AG (DE) 1993-03-24 EP disclosed
JP-H04211045-A MATERIAL FOR DENTAL APPLICATION BAYER AG 1992-08-03 JP disclosed
US-5132335-A ACRYLIC AND METHACRYLIC ESTERS OF SUBSTITUTED 1,2-BIS(PHENOXY)-3,3,4,4,5,5-HEXAFLUORO-1-CYCLOPENTENES BAYER AKTIENGESELLSCHAFT (DE) 1992-07-21 US disclosed
US-5132335-A ACRYLIC AND METHACRYLIC ESTERS OF SUBSTITUTED 1,2-BIS(PHENOXY)-3,3,4,4,5,5-HEXAFLUORO-1-CYCLOPENTENES BAYER AKTIENGESELLSCHAFT (DE) 1992-07-21 US disclosed
US-5132335-A ACRYLIC AND METHACRYLIC ESTERS OF SUBSTITUTED 1,2-BIS(PHENOXY)-3,3,4,4,5,5-HEXAFLUORO-1-CYCLOPENTENES BAYER AKTIENGESELLSCHAFT (DE) 1992-07-21 US disclosed
EP-0443370-A2 Dental materials BAYER AG (DE) 1991-08-28 EP disclosed
EP-0443370-A2 Dental materials BAYER AG (DE) 1991-08-28 EP disclosed
US-4990633-A Used as insulating agents BAYER AKTIENGESELLSCHAFT (DE) 1991-02-05 US disclosed
EP-0343441-A2 Fluorinated bis-aryloxy-substituted alkenes, method for their production an their application BAYER AG (DE) 1989-11-29 EP disclosed