Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | MGAM | O43451 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SI | P14410 | 1/20 | 0.52 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.52 |
| ▸ | PAOX | Q6QHF9 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | POLA1 | P09884 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6821595 | 1.00 | TSHR (0.67) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL3628963 | 1.00 | TSHR (0.67) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL6421942 | 1.00 | TSHR (0.67) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL3626724 | 1.00 | TSHR (0.67) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL16902770 | 1.00 | TSHR (0.67) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL1706595 | 0.97 | TSHR (0.70) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL437127 | 0.92 | TSHR (0.79) | TSHRLMNAALDH1A1MGAMGAA | |
| SCHEMBL10631996 | 0.91 | TSHR (0.56) | TSHRLMNAALDH1A1EPHX2POLB | |
| SCHEMBL11955444 | 0.91 | TSHR (0.61) | TSHRLMNAALDH1A1MGAMGAA | |
| Hydrochloric Acid SCHEMBL27636889 | 0.90 | TSHR (0.75) | TSHRLMNAALDH1A1MGAMGAA |
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-1102736-A2 | PREPARATION OF MACROCYCLIC KETONES UTILISING ADDITION OF KETONES TO ALKENES | QUEST INTERNATIONAL B.V. (NL) | 2001-05-30 | — | — | EP | claimed |
| EP-0976714-A1 | Addition of ketones to alkenes | QUEST INTERNATIONAL B.V. (NL) | 2000-02-02 | — | — | EP | claimed |
| WO-2000001648-A2 | PREPARATION OF MACROCYCLIC KETONES UTILISING ADDITION OF KETONES TO ALKENES | QUEST INTERNATIONAL B.V. (NL) | 2000-01-13 | — | — | WO | claimed |
| EP-1102736-A2 | PREPARATION OF MACROCYCLIC KETONES UTILISING ADDITION OF KETONES TO ALKENES | QUEST INTERNATIONAL B.V. (NL) | 2001-05-30 | — | — | EP | disclosed |
| EP-0976714-A1 | Addition of ketones to alkenes | QUEST INTERNATIONAL B.V. (NL) | 2000-02-02 | — | — | EP | disclosed |
| WO-2000001648-A2 | PREPARATION OF MACROCYCLIC KETONES UTILISING ADDITION OF KETONES TO ALKENES | QUEST INTERNATIONAL B.V. (NL) | 2000-01-13 | — | — | WO | disclosed |