Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LIPE | Q05469 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | NPBWR1 | P48145 | 6/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24316428 | 0.88 | ALKBH1 (0.39) | KDM4ENPBWR1MCHR1NPC1RAB9A | |
| SCHEMBL24316624 | 0.80 | KDM4E (0.36) | KDM4EPIK3CAMTORMCHR1CYP1A2 | |
| SCHEMBL29539473 | 0.80 | KDM4E (0.36) | KDM4EPIK3CAMTORMCHR1CYP1A2 | |
| SCHEMBL24316659 | 0.80 | ALKBH1 (0.40) | KDM4ENPBWR1CYP1A2CYP3A4NPC1 | |
| SCHEMBL24316432 | 0.78 | ACACB (0.37) | PIK3CAMTORMCHR1CYP1A2CYP3A4 | |
| SCHEMBL24316545 | 0.77 | CSF1R (0.43) | KDM4EPIK3CAMTORNPBWR1NPC1 | |
| SCHEMBL24316808 | 0.77 | POLB (0.41) | KDM4EPIK3CAMTORCOMTNPBWR1 | |
| SCHEMBL24316434 | 0.76 | CSF1R (0.53) | KDM4EPIK3CAMTORNPBWR1NPC1 | |
| SCHEMBL24316565 | 0.75 | CSF1R (0.44) | KDM4EPIK3CAMTORNPBWR1NPC1 | |
| SCHEMBL32688112 | 0.68 | KDM4E (0.56) | KDM4ECYP1A2SMN1; SMN2ALDH1A1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022057895-A1 | HETEROAROMATIC COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2022-03-24 | — | — | WO | disclosed |
| US-9585884-B2 | Pyrimidinone inhibitors of lipoprotein-associated phospholipase A2 | AUSPEX PHARMACEUTICALS, INC. (US) | 2017-03-07 | — | — | US | disclosed |