Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.69 |
| ▸ | RAB9A | P51151 | 2/20 | 0.69 |
| ▸ | HTR7 | P34969 | 1/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL318467 | 0.94 | NPC1 (0.77) | NPC1RAB9AHTR7PTPN1TSHR | |
| Ethylene SCHEMBL7326114 | 0.91 | NPC1 (0.71) | NPC1RAB9AHTR7PTPN1TSHR | |
| Iodide SCHEMBL21001678 | 0.91 | NPC1 (0.71) | NPC1RAB9AHTR7PTPN1TSHR | |
| Potassium Iodide SCHEMBL21001677 | 0.89 | NPC1 (0.69) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL5663807 | 0.89 | NPC1 (0.74) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL5660315 | 0.87 | NPC1 (0.71) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL5660071 | 0.87 | NPC1 (0.71) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL11817662 | 0.85 | NPC1 (0.59) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL11680631 | 0.85 | NPC1 (0.80) | NPC1RAB9AHTR7PTPN1TSHR | |
| SCHEMBL6614159 | 0.84 | NPC1 (0.67) | NPC1RAB9AHTR7PTPN1TSHR |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4352811-A | NEUROLEPTIC AGENTS | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1982-10-05 | — | — | US | disclosed |
| US-4321385-A | [(Aryl-1-pyrryl) methyl]-piperidinols and pyrrolidinols | HOECHST ROUSSEL PHARMACEUTICALS INC. (US) | 1982-03-23 | — | — | US | disclosed |
| US-4268515-A | ANALGESICS, HYPOTENSIVE AGENTS | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1981-05-19 | — | — | US | disclosed |
| US-4198420-A | Spiro[dibenz(b,f)thiepin-piperidine]s | AMERICAN HOECHST CORPORATION (US) | 1980-04-15 | — | — | US | disclosed |
| US-4198418-A | ANALGESICS, TRANQUILIZERS, ANTICONVULSANTS | AMERICAN HOECHST CORPORATION (US) | 1980-04-15 | — | — | US | disclosed |
| US-4166120-A | Analgesic and tranquilizing benzoylpropyl-spiro[dihydrobenzofuran]piperidines and pyrrolidines | AMERICAN HOECHST CORPORATION (US) | 1979-08-28 | — | — | US | disclosed |
| US-3952025-A | ANALGESIC, TRANQUILIZER | AMERICAN HOECHST CORPORATION (US) | 1976-04-20 | — | — | US | disclosed |