Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RRM2 | P31350 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8661772 | 0.90 | MAPT (0.47) | ALDH1A1TP53L3MBTL1CYP1A2CYP3A4 | |
| Iodide SCHEMBL3434471 | 0.88 | MAPT (0.46) | ALDH1A1TP53L3MBTL1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL29259617 | 0.88 | MAPT (0.46) | ALDH1A1TP53L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL15928718 | 0.87 | CYP3A4 (0.45) | ALDH1A1TP53L3MBTL1SMN1; SMN2RAB9A | |
| SCHEMBL9273078 | 0.87 | MAPT (0.45) | ALDH1A1TP53L3MBTL1RAB9ANPC1 | |
| SCHEMBL4784858 | 0.81 | ALDH1A1 (0.44) | ALDH1A1TP53L3MBTL1SMN1; SMN2RAB9A | |
| SCHEMBL1485712 | 0.81 | MAPT (0.59) | ALDH1A1TP53L3MBTL1SMN1; SMN2RAB9A | |
| SCHEMBL5549248 | 0.80 | RRM2 (0.38) | ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL9157046 | 0.80 | KMT2A (0.45) | ALDH1A1L3MBTL1SMN1; SMN2RAB9ARRM2 | |
| Hydrochloric Acid SCHEMBL2866031 | 0.79 | MAPT (0.57) | ALDH1A1TP53L3MBTL1SMN1; SMN2RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3168256-B1 | EYEWEAR MATERIAL COMPRISING A POLYURETHANE RESIN, EYEWEAR FRAME AND LENS | MITSUI CHEMICALS INC (JP) | 2019-08-07 | — | — | EP | disclosed |
| EP-3037411-B1 | 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED ARTICLE, EYEWEAR MATERIAL, EYEWEAR FRAME AND LENS | MITSUI CHEMICALS INC (JP) | 2019-03-27 | — | — | EP | disclosed |
| EP-3168256-A1 | 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED ARTICLE, EYEWEAR MATERIAL, EYEWEAR FRAME, AND LENS | Mitsui Chemicals, Inc. (JP) | 2017-05-17 | — | — | EP | disclosed |
| US-9475903-B2 | 1,4-bis(isocyanatomethyl)cyclohexane, polyisocyanate composition, polyurethane resin, molded article, eyewear material, eyewear frame, and lens | MITSUI CHEMICALS, INC. (JP) | 2016-10-25 | — | — | US | disclosed |
| EP-3037411-A1 | 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED PRODUCT, EYEWEAR MATERIAL, EYEWEAR FRAME AND LENS | Mitsui Chemicals, Inc. (JP) | 2016-06-29 | — | — | EP | disclosed |