Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | SCN10A | Q9Y5Y9 | 6/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.42 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9062349 | 0.98 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9061793 | 0.94 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9061635 | 0.93 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9060178 | 0.93 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9061248 | 0.91 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9061383 | 0.90 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9062023 | 0.90 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9060818 | 0.90 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9060868 | 0.89 | RAB9A (0.54) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9060622 | 0.89 | RAB9A (0.54) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5536442-A | ELECTROOPTICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-16 | — | — | US | disclosed |
| US-5324449-A | Substituted phenyl trifluoromethyl ethers | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-06-28 | — | — | US | disclosed |
| EP-0334911-B1 | SUBSTITUTED PHENYLTRIFLUORMETHYLETHERS | MERCK PATENT GmbH (DE) | 1993-02-10 | — | — | EP | disclosed |
| EP-0334911-A1 | SUBSTITUTED PHENYLTRIFLUORMETHYLETHERS | MERCK PATENT GmbH (DE) | 1989-10-04 | — | — | EP | disclosed |