Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.58 |
| ▸ | MPO | P05164 | 1/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.43 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL7779938 | 0.96 | SIGMAR1 (0.57) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL1289512 | 0.91 | SIGMAR1 (0.54) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| Hydrochloric Acid SCHEMBL1289495 | 0.90 | SIGMAR1 (0.53) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL7784806 | 0.86 | SIGMAR1 (0.58) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL9249093 | 0.86 | SIGMAR1 (0.58) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| Hydrochloric Acid SCHEMBL11078947 | 0.84 | MPO (0.55) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL16387896 | 0.82 | SIGMAR1 (0.54) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL7780002 | 0.82 | SIGMAR1 (0.55) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL13937830 | 0.80 | MPO (0.77) | SIGMAR1ABCB1MPOMTNR1BNQO2 | |
| SCHEMBL7787100 | 0.78 | MTNR1A (0.54) | SIGMAR1ABCB1MTNR1BNQO2MTNR1A |
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 7 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-6235789-B1 | GLANDULAR DISORDERS; SLEEP DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | 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 |
| EP-0781271-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1997-07-02 | — | — | 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 |
| WO-1996008466-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-03-21 | — | — | WO | disclosed |