Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.48 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.42 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13320400 | 0.85 | GPR3 (0.52) | GPR3ALKBH5FTOTSHRKIF11 | |
| SCHEMBL23606076 | 0.79 | GPR3 (0.50) | GPR3ALKBH5FTOTSHRKIF11 | |
| SCHEMBL11383782 | 0.77 | L3MBTL1 (0.50) | KDM4EMAPTL3MBTL1ALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL9499951 | 0.73 | GPR3 (0.47) | GPR3ALKBH5FTOTSHRKDM4E | |
| SCHEMBL31132408 | 0.71 | GPR3 (0.61) | GPR3ALKBH5FTOTSHRKDM4E | |
| SCHEMBL483003 | 0.71 | GPR3 (0.61) | GPR3ALKBH5FTOTSHRKDM4E | |
| Iodide SCHEMBL344509 | 0.70 | GPR3 (0.58) | GPR3ALKBH5FTOTSHRKDM4E | |
| Bromide SCHEMBL15569972 | 0.70 | GPR3 (0.58) | GPR3ALKBH5FTOTSHRKDM4E | |
| Bromide SCHEMBL15569971 | 0.70 | GPR3 (0.58) | GPR3ALKBH5FTOTSHRKDM4E | |
| SCHEMBL20746852 | 0.70 | TSHR (0.36) | GPR3ALKBH5FTOTSHRKIF11 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5840915-A | REACTING RACEMIC OXINDOLE WITH CHLOROACETONITRILE IN MIXTURE CONTAINING CATALYST AND SODIUM HYDROXIDE AS DEPROTONATING AGENT, RECRYSATLLIZING, REDUCING NITRILE GROUPS, CONTACTING WITH CHIRAL ACID TO PRECIPITATE SALT | HOECHST MARION ROUSSEL, INC. (US) | 1998-11-24 | — | — | US | disclosed |
| EP-0438796-B1 | Process for the enantioselection synthesis of alkylated oxindoles used as intermediates in the preparation of physostigmine | HOECHST MARION ROUSSEL INC (US) | 1998-08-26 | — | — | EP | disclosed |
| US-5521320-A | ALKYLATED OXINDOLE | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1996-05-28 | — | — | US | disclosed |
| EP-0418770-B1 | Process for the chemical resolution of 5-alkoxy-substituted (+/-)-1,3-dimethyloxindolylethylamines | HOECHST ROUSSEL PHARMA (US) | 1995-07-19 | — | — | EP | disclosed |
| US-5387695-A | Precipitating one of the enantiomers in the form of the salt of a chiral acid | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1995-02-07 | — | — | US | disclosed |
| US-5274117-A | Heating a racemic oxindole, a halogenated acetonitrile and a catalyst to form the alkylated oxindole | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1993-12-28 | — | — | US | disclosed |