Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.64 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.58 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.58 |
| ▸ | BACE1 | P56817 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NPY1R | P25929 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NPY2R | P49146 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.54 |
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL5593811 | 0.86 | CCNC (0.50) | HDAC8HDAC6MTNR1AMTNR1BBACE1 | |
| Cyclopropane SCHEMBL11853273 | 0.85 | HDAC8 (0.51) | HDAC8HDAC6MTNR1AMTNR1BBACE1 | |
| SCHEMBL23606857 | 0.84 | KMT2A (0.49) | HDAC8HDAC6MTNR1AMTNR1BSMN1; SMN2 | |
| SCHEMBL29162887 | 0.84 | HDAC8 (0.60) | HDAC8HDAC6MTNR1AMTNR1BBACE1 | |
| SCHEMBL10438847 | 0.84 | ALDH1A1 (0.58) | SMN1; SMN2MAPTALDH1A1CYP1A2HPGD | |
| SCHEMBL69522 | 0.84 | ALDH1A1 (0.58) | SMN1; SMN2MAPTALDH1A1CYP1A2HPGD | |
| SCHEMBL5459262 | 0.83 | MTNR1A (0.53) | HDAC8HDAC6MTNR1AMTNR1BBACE1 | |
| SCHEMBL5399861 | 0.83 | HDAC8 (0.55) | HDAC8HDAC6MTNR1AMTNR1BBACE1 | |
| SCHEMBL14930449 | 0.83 | L3MBTL1 (0.52) | HDAC8HDAC6MTNR1AMTNR1BSMN1; SMN2 | |
| SCHEMBL2690695 | 0.83 | HDAC8 (0.55) | HDAC8HDAC6MTNR1AMTNR1BBACE1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104311415-B | A kind of carboxylic acid and the method for dimethyl malenate esterification | 苏州波菲特新材料科技有限公司 | 2016-08-17 | — | — | CN | disclosed |
| CN-104311415-A | Method for etherification of carboxyl acid and dimethyl malonate | SUZHOU BOFEITE NEW MATERIAL TECHNOLOGY CO LTD | 2015-01-28 | — | — | CN | disclosed |
| EP-1313560-B1 | CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION | UNIV YALE (US) | 2007-12-19 | — | — | EP | disclosed |
| EP-1313560-A4 | CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION | UNIV YALE (US) | 2005-02-09 | — | — | EP | disclosed |
| EP-1313560-A1 | CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION | YALE UNIVERSITY (US) | 2003-05-28 | — | — | EP | disclosed |
| US-6562989-B2 | Bicyclopentyl iron ligand and transition metal catalyst | YALE UNIVERSITY | 2003-05-13 | — | — | US | disclosed |
| US-20030008768-A1 | Catalyst for aromatic C-O, C-N, and C-C bond formation | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-01-09 | — | — | US | disclosed |
| WO-2002011883-A1 | CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION | YALE UNIVERSITY (US) | 2002-02-14 | — | — | WO | disclosed |
| EP-0376516-B1 | METHOD OF PREPARATION OF NABUMETONE | HOECHST CELANESE CORPORATION (US) | 1993-02-10 | — | — | EP | disclosed |
| EP-0376516-A1 | Method of preparation of nabumetone | HOECHST CELANESE CORPORATION (US) | 1990-07-04 | — | — | EP | disclosed |