Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | SLC18A2 | Q05940 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28430470 | 0.87 | CYP2D6 (0.50) | CYP2D6TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL5838621 | 0.85 | TDP1 (0.39) | TDP1CYP3A4CYP2D6TRPA1TAAR1 | |
| SCHEMBL301154 | 0.85 | TDP1 (0.39) | TDP1CYP3A4CYP2D6TAAR1SLC6A2 | |
| SCHEMBL10412405 | 0.83 | TDP1 (0.38) | TDP1CYP3A4CYP2D6TAAR1SLC6A2 | |
| Bromide SCHEMBL1582867 | 0.81 | TDP1 (0.36) | TDP1CYP3A4CYP2D6TAAR1SLC6A2 | |
| SCHEMBL13722624 | 0.81 | MAOA (0.46) | CYP2D6TAAR1SLC6A2SIGMAR1MAOA | |
| Hydrochloric Acid SCHEMBL1582787 | 0.81 | TDP1 (0.36) | TDP1CYP3A4CYP2D6TAAR1SLC6A2 | |
| SCHEMBL3297250 | 0.81 | LMNA (0.42) | TDP1CYP3A4CYP2D6TRPA1ESR1 | |
| SCHEMBL14980410 | 0.80 | CYP3A4 (0.36) | CYP3A4 | |
| SCHEMBL6291622 | 0.79 | TAAR1 (0.50) | TRPA1TAAR1MAOA |
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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090156763-A1 | Process for manufacturing a thermoplastic elastomeric material | PIRELLI & C. S.P.A. (IT) | 2009-06-18 | — | — | US | claimed |
| EP-1970360-B1 | Method for producing alcohols | TAKASAGO PERFUMERY CO LTD (JP) | 2016-08-31 | — | — | EP | disclosed |
| US-7569735-B2 | Reducing esters or lactones with hydrogen gas in presence of ruthenium catalyst; high yield and high catalytic efficiency under an industrially advantageous condition of relatively low hydrogen pressure and low reaction temperature | TAKASAGO INTERNATIONAL (JP) | 2009-08-04 | — | — | US | disclosed |
| US-20090156763-A1 | Process for manufacturing a thermoplastic elastomeric material | PIRELLI & C. S.P.A. (IT) | 2009-06-18 | — | — | US | disclosed |
| US-20080228012-A1 | Reducing esters or lactones with hydrogen gas in presence of ruthenium catalyst; high yield and high catalytic efficiency under an industrially advantageous condition of relatively low hydrogen pressure and low reaction temperature | TAKASAGO INTERNATIONAL CORPORATION | 2008-09-18 | — | — | US | disclosed |
| EP-1970360-A1 | Method for producing alcohols | Takasago International Corporation (JP) | 2008-09-17 | — | — | EP | disclosed |
| US-6835850-B2 | Reacting a conjugated diene with carbon monoxide and an alcohol to form an alkenoic ester by using a durable catalyst complex of palladium cations, a ligand of bridged phospha-cycloalkanes and source of anions; by-product inhibition | DSW IP ASSETS B.V. (NL) | 2004-12-28 | — | — | US | disclosed |
| US-20040039226-A1 | Process for the carbonylation of a conjugated diene | DSM IP ASSETS B.V. (NL) | 2004-02-26 | — | — | US | disclosed |
| US-6268530-B1 | SEPARATING LINEAR 5-FORMYLVALERIC ACID FROM MIXTURE OF 5- AND 3-AND/OR 4-BRANCHED FORMYLVALERIC ACIDS BY SEPARATING FRACTIONAL EXTRACTION WITH TWO IMMISCIBLE SOLVENTS | DSM N.V. (NL) | 2001-07-31 | — | — | US | disclosed |
| EP-0836588-B1 | PROCESS TO PREPARE 5-FORMYLVALERIC ACID | DSM NV (NL) | 2000-05-17 | — | — | EP | disclosed |
| US-4818810-A | USING POLYMERIZATION CATALYST OF REACTION PRODUCT OF GROUP EIGHT COMPOUND, LIGAND AND ACID | SHELL OIL COMPANY (US) | 1989-04-04 | — | — | US | disclosed |
| EP-0293999-A2 | Process for the coproduction of anilines and oxamides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-12-07 | — | — | EP | disclosed |
| EP-0293053-A2 | Process for the preparation of cyclic carboxylic anhydrides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-11-30 | — | — | EP | disclosed |
| EP-0181014-B1 | PROCESS FOR THE PREPARATION OF POLYKETONES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-11-30 | — | — | EP | disclosed |
| EP-0284170-A1 | Process for the preparation of a diester of adipic acid | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-09-28 | — | — | EP | disclosed |
| US-4731487-A | Process for the preparation of aldehydes | SHELL OIL COMPANY (US) | 1988-03-15 | — | — | US | disclosed |
| EP-0250037-A2 | Process for the preparation of urea derivatives and catalyst system | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-12-23 | — | — | EP | disclosed |
| EP-0227160-A2 | Process for the carbonylation of ethylenically unsaturated compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-07-01 | — | — | EP | disclosed |
| EP-0220767-A1 | Process for the preparation of aldehydes | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-05-06 | — | — | EP | disclosed |
| EP-0121965-A2 | Process for the preparation of polyketones | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1984-10-17 | — | — | EP | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20040039226-A1 | Process for the carbonylation of a conjugated diene | ROS1, DOHH, NOXO1 | TDP1 2645/4885CYP3A4 209/4885CYP2D6 185/4885 |
| US-20080228012-A1 | Reducing esters or lactones with hydrogen gas in presence of ruthenium catalyst; high yield and high catalytic efficiency under an industrially advantageous condition of relatively low hydrogen pressure and low reaction temperature | LPXN, LIPE, MLX | TDP1 3947/4885CYP3A4 1279/4885CYP2D6 3379/4885 |
“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.