Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.59 |
| ▸ | NPC1 | O15118 | 6/20 | 0.59 |
| ▸ | RAB9A | P51151 | 6/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.54 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27706614 | 0.84 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL28320559 | 0.79 | NPC1 (0.56) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL1521239 | 0.79 | NPC1 (0.67) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL27883013 | 0.77 | NPC1 (0.65) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL660014 | 0.77 | MAPT (0.67) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL620659 | 0.77 | UBE2T (0.59) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL26095926 | 0.77 | SMN1; SMN2 (0.59) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL6964094 | 0.76 | NPC1 (0.71) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 | |
| SCHEMBL28031301 | 0.75 | DYRK1A (0.46) | — | |
| 2-(Phenoxymethyl)Benzothiazole SCHEMBL2245843 | 0.75 | NPC1 (1.00) | SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110292948-A | Imidazoles villaumite containing single imines functionalization is preparing the application in aromatic heterocycle formic ether compounds as catalyst | 苏州大学 | 2019-10-01 | — | — | CN | disclosed |
| CN-106565623-B | Method for synthesizing aromatic heterocyclic formate compound | 苏州大学 | 2019-07-16 | — | — | CN | disclosed |
| EP-2590944-A1 | 1-PHENYL-SUBSTITUTED HETEROCYCLYL DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | Actelion Pharmaceuticals Ltd. (CH) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012004722-A1 | 1-PHENYL-SUBSTITUTED HETEROCYCLYL DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2012-01-12 | — | — | WO | disclosed |
| CN-1694704-A | Use of (1H-benzimidazole-2-yl)-(piperazineyl)- ketaderavitive and correlative compound used as histamine H4 receptor antagonist for the treatment of allergy and asthma | JANSSEN PHARMACEUTICA NV (BE) | 2005-11-09 | — | — | CN | disclosed |