Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4975474 | 0.78 | SIGMAR1 (0.36) | SIGMAR1HTR2AHRH1LMNA | |
| SCHEMBL4613507 | 0.76 | TSHR (0.39) | SIGMAR1LMNA | |
| SCHEMBL2464159 | 0.75 | SIGMAR1 (0.31) | SIGMAR1 | |
| SCHEMBL3184970 | 0.72 | MAPT (0.44) | HTR2AHRH1LMNA | |
| SCHEMBL22738465 | 0.71 | DRD3 (0.37) | SIGMAR1HTR2AHRH1 | |
| SCHEMBL27957024 | 0.71 | TSHR (0.41) | LMNA | |
| Benzene SCHEMBL28133117 | 0.70 | ALDH1A1 (0.43) | HTR2AHRH1LMNA | |
| SCHEMBL18837041 | 0.69 | MAPT (0.37) | SIGMAR1HTR2AHRH1LMNA | |
| SCHEMBL24685224 | 0.69 | TSHR (0.45) | — | |
| SCHEMBL16304006 | 0.68 | ACHE (0.38) | SIGMAR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0343714-B1 | Phenylglycidate stereoisomers, conversion products thereof with e.g. 2-nitrothiophenol and preparation of diltiazem | DSM NV (NL) | 1994-11-02 | — | — | EP | claimed |
| EP-0343714-A1 | Phenylglycidate stereoisomers, conversion products thereof with e.g. 2-nitrothiophenol and preparation of diltiazem | DSM N.V. (NL) | 1989-11-29 | — | — | EP | claimed |
| US-6197953-B1 | ESTER INTERCHANGE, CRYSTALLIZATION, ISOMERIZATION; PREPARING 1,5-BENZOTHIAZEPINE DERIVATIVES | TANABE SEIYAKU CO., LTD. (JP) | 2001-03-06 | — | — | US | disclosed |
| US-5998637-A | CRYSTALLIZATION; SEPARATION | TANABE SEIYAKU CO., LTD. (JP) | 1999-12-07 | — | — | US | disclosed |
| EP-0861834-A1 | Process for preparing optically active trans-3-substituted glycidic acid ester | TANABE SEIYAKU CO., LTD. (JP) | 1998-09-02 | — | — | EP | disclosed |
| EP-0343714-A1 | Phenylglycidate stereoisomers, conversion products thereof with e.g. 2-nitrothiophenol and preparation of diltiazem | DSM N.V. (NL) | 1989-11-29 | — | — | EP | disclosed |