Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL901116 | 0.81 | MAPT (0.31) | MAPTNPC1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL9360456 | 0.69 | CHRM2 (0.32) | — | |
| SCHEMBL11068386 | 0.68 | KDM4E (0.32) | — | |
| SCHEMBL10484417 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL24847709 | 0.62 | — | — | |
| SCHEMBL2689523 | 0.61 | — | — | |
| SCHEMBL30581233 | 0.59 | ALDH1A1 (0.44) | MAPT | |
| SCHEMBL13451210 | 0.59 | — | — | |
| SCHEMBL9951514 | 0.59 | MAPT (0.41) | MAPTNPC1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL8344751 | 0.59 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3362428-A1 | NOVEL OCTAHYDROINDENYL PROPANAL COMPOUNDS | International Flavors & Fragrances Inc. (US) | 2018-08-22 | — | — | EP | claimed |
| WO-2017066214-A1 | NOVEL OCTAHYDROINDENYL PROPANAL COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-04-20 | — | — | WO | claimed |
| EP-3362428-A1 | NOVEL OCTAHYDROINDENYL PROPANAL COMPOUNDS | International Flavors & Fragrances Inc. (US) | 2018-08-22 | — | — | EP | disclosed |
| WO-2017066214-A1 | NOVEL OCTAHYDROINDENYL PROPANAL COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-04-20 | — | — | WO | disclosed |