Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PIK3C2B | O00750 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29967780 | 0.86 | PPARG (0.45) | KDM4EALDH1A1PIK3C2BPPARGACMSD | |
| SCHEMBL29968433 | 0.86 | CYP19A1 (0.39) | PIK3C2BPTGS2CNR2CNR1PPARG | |
| SCHEMBL29968198 | 0.85 | DCTPP1 (0.42) | GALR3NR2F2RAB9APPARGPDE10A | |
| SCHEMBL29968296 | 0.85 | PPARG (0.39) | ALDH1A1LMNAMAPK1PIK3C2BNPC1 | |
| SCHEMBL29968438 | 0.82 | TSHR (0.37) | KDM4EMEN1ALDH1A1KMT2ALMNA | |
| SCHEMBL29967688 | 0.81 | CNR2 (0.38) | KDM4EHSD17B10PTGS2CNR2CNR1 | |
| SCHEMBL29968232 | 0.81 | PDE10A (0.40) | GALR3NR2F2RAB9APPARGPDE10A | |
| SCHEMBL29967971 | 0.80 | PPARG (0.42) | PPARG | |
| SCHEMBL29968012 | 0.80 | NR1H4 (0.46) | KDM4EMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL29968901 | 0.80 | DCTPP1 (0.53) | KDM4EALDH1A1MAPTLMNAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260165-B | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2024-08-06 | — | — | CN | disclosed |
| CN-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |