Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 1/20 | 0.51 |
| ▸ | CA6 | P23280 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | TPMT | P51580 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7362278 | 1.00 | KDM4E (0.59) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL10780177 | 0.93 | KDM4E (0.56) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL142851 | 0.91 | PDE4D (0.54) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL2564619 | 0.87 | CA12 (0.71) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL16959609 | 0.86 | KDM4E (0.55) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL3738587 | 0.85 | MAPT (0.64) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL4696721 | 0.85 | KDM4E (0.58) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL29824542 | 0.85 | KDM4E (0.61) | KDM4EHTTRAB9ATSHRNPC1 | |
| SCHEMBL5466423 | 0.85 | ALDH1A1 (0.56) | RAB9ATSHRNPC1SMN1; SMN2TP53 | |
| SCHEMBL29399077 | 0.84 | TSHR (0.73) | TSHRSMN1; SMN2MAPK1CYP1A2CYP3A4 |
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-114945368-B | N2-arylmethyl-4-haloalkyl-pyridazin-3-one compounds and uses thereof | 香槟-阿尔登兰斯大学 | 2025-01-10 | — | — | CN | disclosed |
| CN-114945368-A | N2-arylmethyl-4-haloalkyl-pyridazin-3-one compounds and uses thereof | 香槟-阿尔登兰斯大学 | 2022-08-26 | — | — | CN | disclosed |