Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.67 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.55 |
| ▸ | SQLE | Q14534 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11388757 | 1.00 | KDM1A (0.67) | KDM1APTPN1SQLEKMT2AMAPT | |
| Magnesium Chloride Anhydrous SCHEMBL27256384 | 0.93 | KDM1A (0.59) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL2579524 | 0.92 | KDM1A (0.71) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL671250 | 0.87 | PTPN1 (0.55) | KDM1APTPN1KMT2AMEN1CYP3A4 | |
| SCHEMBL671249 | 0.87 | PTPN1 (0.55) | KDM1APTPN1KMT2AMEN1CYP3A4 | |
| SCHEMBL9474828 | 0.86 | PTPN1 (0.73) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL6711357 | 0.86 | PTPN1 (0.73) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL8082844 | 0.86 | PTPN1 (0.73) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL13611377 | 0.86 | PTPN1 (0.73) | KDM1APTPN1SQLEKMT2AMAPT | |
| SCHEMBL7933398 | 0.86 | PTPN1 (0.73) | KDM1APTPN1SQLEKMT2AMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4293497-A | ALKYLATION CATALYSTS, VIATMIN E | SCM CORPORATION (US) | 1981-10-06 | — | — | US | disclosed |
| US-4292454-A | INTERMEDIATES FOR VITAMIN E | SCM CORPORATION (US) | 1981-09-29 | — | — | US | disclosed |
| US-4292459-A | Coupling reaction involving a Grignard and allylic halide | SCM CORPORATION (US) | 1981-09-29 | — | — | US | disclosed |
| US-4228313-A | TO PREPARE A REARRANGED UNSATURATED HYDROCARBON | SCM CORPORATION (US) | 1980-10-14 | — | — | US | disclosed |
| US-4221742-A | Coupling reaction involving a Grignard and allylic halide | SCM CORPORATION (US) | 1980-09-09 | — | — | US | disclosed |