Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | CASP3 | P42574 | 1/20 | 0.58 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.58 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.58 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13468550 | 0.85 | NPC1 (0.53) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13469226 | 0.81 | SMN1; SMN2 (0.41) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL8459424 | 0.81 | SMN1; SMN2 (0.41) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL12756964 | 0.79 | NPC1 (0.64) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13468548 | 0.79 | NPC1 (0.50) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13351520 | 0.79 | SMN1; SMN2 (0.49) | NPC1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL5407676 | 0.79 | SMN1; SMN2 (0.49) | NPC1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL15614329 | 0.78 | ALDH1A1 (0.42) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL8274396 | 0.78 | SMN1; SMN2 (0.39) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13915486 | 0.78 | SMN1; SMN2 (0.39) | NPC1CASP3SENP8SENP7SENP6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3169662-B1 | SUBSTITUTED VINYL- AND ALKINYL-CYANOCYCLOALKANOLS AND VINYL- AND ALKINYL-CYANOHETEROCYCLOALKANOLS AS AGENTS TO COMBAT ABIOTIC PLANT STRESS | BAYER CROPSCIENCE AG (DE) | 2018-07-11 | — | — | EP | disclosed |
| EP-2510786-A1 | Substituted Prop-2-in-1-ol and Prop-2-en-1-ol derivatives | Bayer CropScience AG (DE) | 2012-10-17 | — | — | EP | disclosed |