Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.62 |
| ▸ | METAP1 | P53582 | 2/20 | 0.62 |
| ▸ | ACHE | P22303 | 5/20 | 0.58 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.53 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30667087 | 1.00 | CYP19A1 (0.62) | CYP19A1METAP1ACHECYP24A1CYP26A1 | |
| SCHEMBL5582351 | 0.89 | CYP19A1 (0.77) | CYP19A1METAP1ACHECYP24A1CYP26A1 | |
| Bromide SCHEMBL2331283 | 0.89 | ACHE (0.76) | CYP19A1METAP1ACHE | |
| Hydrochloric Acid SCHEMBL2329151 | 0.89 | ACHE (0.74) | CYP19A1METAP1ACHE | |
| SCHEMBL7249809 | 0.88 | CYP19A1 (0.80) | CYP19A1METAP1CYP24A1CYP26A1 | |
| SCHEMBL6378133 | 0.87 | CYP19A1 (0.81) | CYP19A1METAP1ACHE | |
| SCHEMBL19748689 | 0.83 | CYP19A1 (0.63) | CYP19A1METAP1ACHECYP24A1CYP26A1 | |
| SCHEMBL15700137 | 0.82 | ACHE (0.80) | ACHE | |
| SCHEMBL9659968 | 0.82 | METAP1 (0.54) | CYP19A1METAP1ACHECYP24A1CYP26A1 | |
| SCHEMBL12330473 | 0.82 | METAP1 (0.59) | CYP19A1METAP1ACHEMEN1KMT2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0848699-B1 | BENZOCYCLOALKENE COMPOUNDS WITH MELATONINE RECEPTOR BINDING AFFINITY, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-10-24 | — | — | EP | disclosed |
| US-5998451-A | LIPOXYGENASE INHIBITORS | PFIZER INC (US) | 1999-12-07 | — | — | US | disclosed |
| US-5922771-A | MELATONIN RECEPTOR AGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-07-13 | — | — | US | disclosed |
| EP-0848699-A1 | BENZOCYCLOALKENE COMPOUNDS WITH MELATONINE RECEPTOR BINDING AFFINITY, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1998-06-24 | — | — | EP | disclosed |
| WO-1997005098-A1 | BENZOCYCLOALKENE COMPOUNDS WITH MELATONINE RECEPTOR BINDING AFFINITY, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-02-13 | — | — | WO | disclosed |
| EP-0313295-B1 | SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA, ARTHRITIS AND RELATED DISEASES | PFIZER INC. (US) | 1993-07-28 | — | — | EP | disclosed |
| US-5059609-A | Lipoxygenase inhibitors; leukotriene receptor blockers; psoriasis; antiulcer agents and myocardial infarctions | PFIZER INC. (US) | 1991-10-22 | — | — | US | disclosed |
| EP-0313295-A2 | Substituted tetralins, chromans and related compounds in the treatment of asthma, arthritis and related diseases | PFIZER INC. (US) | 1989-04-26 | — | — | EP | disclosed |