SCHEMBL8609628

SCHEMBL8609628

O=[P](c1cc(F)cc(F)c1)c1cc(F)cc(F)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL1506225 0.73 CA12 (0.42) CES2CES1CA12CA1CA9
SCHEMBL2155777 0.73 CES2 (0.43) CES2CES1
SCHEMBL449836 0.71
SCHEMBL8610016 0.69 CA12 (0.45) CES2CES1CA12CA1CA9
SCHEMBL1305286 0.69 CES2 (0.39) CES2CES1CA1CA9
SCHEMBL12621192 0.69 CA12 (0.45) CES2CES1CA12CA1CA9
SCHEMBL8019916 0.69 CA12 (0.38) CES2CES1CA12CA1CA9
SCHEMBL2881917 0.69 CA12 (0.38) CES2CES1CA12CA1CA9
Formaldehyde SCHEMBL29071035 0.68 CES2 (0.50) CES2CES1CA12CA1CA9
SCHEMBL30029222 0.68 NFE2L2 (0.42) CES2CES1

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-0832087-A1 SYNTHESIS OF AND HYDROFORMYLATION WITH FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1998-04-01 EP claimed
US-5616785-A BIS/3,5-DIFLUOROPHENYL/PHOSPHINE OXIDE AND BIS/3,5-DIFLUOROPHENYL/-PHOSPHINOUS ACID; CHEMICAL INTERMEDIATES FOR FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1997-04-01 US claimed
WO-1996038456-A1 SYNTHESIS OF AND HYDROFORMYLATION WITH FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1996-12-05 WO claimed
US-11063223-B2 Organic electron transport material and organic electroluminescent element using same DYDEN CORPORATION (JP) 2021-07-13 US disclosed
US-20180375032-A1 ORGANIC ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME DYDEN CORPORATION (JP) 2018-12-27 US disclosed
CN-108475735-A ORGANIC ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 大电株式会社 2018-08-31 CN disclosed
US-5789624-A HYDROFORMYLATION OF ALKENES TO ALDEHYDES USING A RHODIUM COMPLEX CATALYST HOECHST CELANESE CORPORATION (US) 1998-08-04 US disclosed
US-5773661-A REACTION OF ALKALI METAL PHOSPHIDE WITH DISULFONIC ACID ESTEROF TRANS-2,3-NOBORNANEDIMETHANOL CELANESE INTERNATIONAL CORPORATION (US) 1998-06-30 US disclosed
EP-0832087-A1 SYNTHESIS OF AND HYDROFORMYLATION WITH FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1998-04-01 EP disclosed
US-5710338-A FLUOROPHENYLPHOSPHINE LIGANDS FOR CATALYSTS HOECHST CELANESE CORPORATION (US) 1998-01-20 US disclosed
US-5710337-A RHODIUM COMPLEX OF BIS PHOSPHINE HOECHST CELANESE CORPORATION (US) 1998-01-20 US disclosed
US-5616785-A BIS/3,5-DIFLUOROPHENYL/PHOSPHINE OXIDE AND BIS/3,5-DIFLUOROPHENYL/-PHOSPHINOUS ACID; CHEMICAL INTERMEDIATES FOR FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1997-04-01 US disclosed
WO-1996038456-A1 SYNTHESIS OF AND HYDROFORMYLATION WITH FLUORO-SUBSTITUTED BIDENTATE PHOSPHINE LIGANDS HOECHST CELANESE CORPORATION (US) 1996-12-05 WO disclosed
US-5567856-A USING A RHODIUM COMPLEX CATALYST HOECHST CELANESE CORPORATION (US) 1996-10-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11063223-B2 Organic electron transport material and organic electroluminescent element using same SLCO2A1, SLCO4C1, SLCO2B1 CES2 639/4885CES1 1908/4885CA12 1772/4885
US-20180375032-A1 ORGANIC ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME SLCO2A1, SLCO4C1, SLCO2B1 CES2 639/4885CES1 1908/4885CA12 1772/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.