Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12621192 | 0.81 | CA12 (0.45) | CA12CA1CA9CES2CES1 | |
| SCHEMBL1506225 | 0.73 | CA12 (0.42) | CA12CA1CA9CES2CES1 | |
| SCHEMBL449836 | 0.71 | — | — | |
| SCHEMBL19968355 | 0.69 | CA12 (0.38) | CA12CA1CA9CES2CES1 | |
| SCHEMBL8059616 | 0.69 | ORAI1 (0.39) | CA1CA9CES2CES1IDO1 | |
| SCHEMBL8019916 | 0.69 | CA12 (0.38) | CA12CA1CA9CES2CES1 | |
| SCHEMBL8609628 | 0.69 | CES2 (0.39) | CA12CA1CA9CES2CES1 | |
| SCHEMBL2881917 | 0.69 | CA12 (0.38) | CA12CA1CA9CES2CES1 | |
| Methyl Alcohol SCHEMBL27837464 | 0.68 | CA9 (0.60) | CA12CA1CA9CES2CES1 | |
| SCHEMBL6250580 | 0.67 | CA12 (0.36) | CA12CA1CA9CES2CES1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0739333-B1 | SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS | DU PONT (US) | 1998-10-14 | — | — | EP | 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 |
| EP-0739333-A1 | SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-10-30 | — | — | EP | disclosed |
| US-5567856-A | USING A RHODIUM COMPLEX CATALYST | HOECHST CELANESE CORPORATION (US) | 1996-10-22 | — | — | US | disclosed |
| US-5510507-A | COORDINATION CATALYSTS; EFFICIENT ENANTIOSELECTIVITY | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-04-23 | — | — | US | disclosed |
| US-5481006-A | PREPARATION OF INTERMEDIATES FOR PHARMACEUTICALS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-01-02 | — | — | US | disclosed |
| WO-1995018787-A1 | SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-07-13 | — | — | WO | disclosed |