Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.70 |
| ▸ | RAB9A | P51151 | 6/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.70 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.70 |
| ▸ | GRM5 | P41594 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 4/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.56 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.56 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL22757188 | 0.86 | NPC1 (0.74) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL16592779 | 0.86 | NPC1 (0.55) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL23911673 | 0.86 | SMN1; SMN2 (0.53) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL12692348 | 0.84 | RAB9A (0.67) | NPC1SMN1; SMN2RAB9ATP53L3MBTL1 | |
| Pifexole SCHEMBL2110643 | 0.83 | SMN1; SMN2 (1.00) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL5959963 | 0.83 | RAB9A (0.77) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| Pifexole SCHEMBL29897050 | 0.83 | SMN1; SMN2 (1.00) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL3432472 | 0.81 | NPC1 (0.64) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL30729303 | 0.81 | NPC1 (0.64) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL4187023 | 0.81 | GRM5 (1.00) | NPC1SMN1; SMN2RAB9ACYP1A2CYP2C19 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0036711-B1 | PESTICIDAL HETEROCYCLIC COMPOUNDS, PROCESSES FOR PREPARING THEM, COMPOSITIONS CONTAINING THEM, AND THEIR USE | FBC LIMITED (GB) | 1985-12-04 | — | — | EP | claimed |
| EP-0036711-A2 | Pesticidal heterocyclic compounds, processes for preparing them, compositions containing them, and their use | FBC LIMITED (GB) | 1981-09-30 | — | — | EP | claimed |
| EP-0325336-B1 | OXADIAZOLE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS PESTICIDES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-08-04 | — | — | EP | disclosed |
| US-4929628-A | Oxadiazole compounds, their preparation and their use as pesticides | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ, B. V. (NL) | 1990-05-29 | — | — | US | disclosed |
| EP-0325336-A1 | Oxadiazole compounds, their preparation and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-07-26 | — | — | EP | disclosed |
| EP-0036711-B1 | PESTICIDAL HETEROCYCLIC COMPOUNDS, PROCESSES FOR PREPARING THEM, COMPOSITIONS CONTAINING THEM, AND THEIR USE | FBC LIMITED (GB) | 1985-12-04 | — | — | EP | disclosed |
| US-4414221-A | MITICIDES, INSECTICIDES, APHIDICIDES | FBC LIMITED (GB) | 1983-11-08 | — | — | US | disclosed |
| EP-0036711-A2 | Pesticidal heterocyclic compounds, processes for preparing them, compositions containing them, and their use | FBC LIMITED (GB) | 1981-09-30 | — | — | EP | disclosed |