Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA3 | P07451 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 1/20 | 0.51 |
| ▸ | CA6 | P23280 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13978402 | 0.87 | NPC1 (0.62) | NPC1RAB9ALMNAALDH1A1KDM4E | |
| SCHEMBL18041117 | 0.83 | ALDH1A1 (0.69) | NPC1RAB9ALMNAALDH1A1KDM4E | |
| SCHEMBL28920305 | 0.79 | ALDH1A1 (0.59) | NPC1RAB9ALMNAALDH1A1KDM4E | |
| SCHEMBL2229042 | 0.79 | KMT2A (0.59) | NPC1RAB9AKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL2487814 | 0.75 | NPC1 (0.70) | NPC1RAB9ALMNAALDH1A1HPGD | |
| SCHEMBL9978790 | 0.75 | KMT2A (0.69) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL435720 | 0.75 | KMT2A (0.69) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL9979280 | 0.75 | KMT2A (0.69) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL2911740 | 0.75 | KMT2A (0.69) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL2915946 | 0.75 | KMT2A (0.69) | NPC1RAB9AALDH1A1KDM4EHPGD |
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-0198202-B1 | NOVEL N-CYCLOHEXYL-POLYCARBOXAMIDE COMPOUND AND DERIVATIVES THEREOF, PROCESSES FOR PREPARING THEM, AND USE OF THEM IN PREPARATION OF HOST-GUEST COMPLEXES | MITSUBISHI CORPORATION (JP) | 1991-07-17 | — | — | EP | claimed |
| EP-0198202-A2 | Novel N-cyclohexyl-polycarboxamide compound and derivatives thereof, processes for preparing them, and use of them in preparation of host-guest complexes | MITSUBISHI CORPORATION (JP) | 1986-10-22 | — | — | EP | claimed |