Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 10/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11187396 | 0.86 | ESR2 (0.68) | ESR2HRH3NPC1RAB9A | |
| SCHEMBL11187392 | 0.86 | ESR2 (0.68) | ESR2HRH3NPC1RAB9A | |
| SCHEMBL4321926 | 0.86 | SPHK1 (0.50) | ESR2SPHK1SPHK2 | |
| SCHEMBL11287625 | 0.86 | SPHK1 (0.50) | ESR2HRH3SPHK1SPHK2 | |
| SCHEMBL12699139 | 0.84 | FASN (0.43) | ESR2HRH3SPHK1S1PR1S1PR5 | |
| SCHEMBL16286046 | 0.84 | FASN (0.43) | ESR2HRH3SPHK1S1PR1S1PR5 | |
| SCHEMBL6457309 | 0.84 | ESR2 (0.38) | ESR2HRH3SPHK1RAB9AS1PR1 | |
| SCHEMBL6457311 | 0.84 | ESR2 (0.38) | ESR2HRH3SPHK1RAB9AS1PR1 | |
| SCHEMBL14048316 | 0.84 | ESR2 (0.56) | ESR2HRH3SPHK1NPC1RAB9A | |
| SCHEMBL9454666 | 0.84 | ESR2 (0.41) | ESR2SPHK1NPC1RAB9AS1PR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0022183-B1 | DERIVATIVES OF CYCLOHEXYLBIPHENYL, PROCESS FOR THEIR PREPARATION, DIELECTRICS CONTAINING THEM, AND ELECTRON OPTICAL INDICATING ELEMENTS | MERCK PATENT GmbH (DE) | 1982-06-23 | — | — | EP | disclosed |
| US-4330426-A | Cyclohexylbiphenyls, their preparation and use in dielectrics and electrooptical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1982-05-18 | — | — | US | disclosed |
| EP-0022183-A2 | Derivatives of cyclohexylbiphenyl, process for their preparation, dielectrics containing them, and electron optical indicating elements | MERCK PATENT GmbH (DE) | 1981-01-14 | — | — | EP | disclosed |