Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.55 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL60290 | 0.85 | KIF11 (0.63) | KIF11KDRMEN1KMT2ATSHR | |
| SCHEMBL29572624 | 0.85 | KIF11 (0.63) | KIF11KDRMEN1KMT2ATSHR | |
| SCHEMBL29416601 | 0.79 | KIF11 (0.77) | KIF11MEN1KMT2ATSHRTRPV1 | |
| SCHEMBL14959294 | 0.79 | KIF11 (0.77) | KIF11MEN1KMT2ATSHRTRPV1 | |
| SCHEMBL7759291 | 0.76 | MEN1 (0.56) | KIF11KDRMEN1KMT2ACA12 | |
| SCHEMBL30499687 | 0.76 | MEN1 (0.56) | KIF11KDRMEN1KMT2ACA12 | |
| SCHEMBL20557336 | 0.76 | MEN1 (0.75) | KIF11MEN1KMT2ACA12CA1 | |
| SCHEMBL28141674 | 0.74 | TAS2R14 (0.57) | KIF11MEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL1091582 | 0.74 | ALDH1A1 (0.66) | MEN1KMT2ATSHRTRPV1ALDH1A1 | |
| SCHEMBL30377979 | 0.72 | DGAT1 (0.43) | KIF11KMT2AALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117120442-A | Tricyclic compounds useful for treating cancer, autoimmune disorders, and inflammatory disorders | 薛定谔公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-117120447-A | Cyclic compounds and methods of use thereof | 薛定谔公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-116490507-A | Heterocyclic condensation CDC7 kinase inhibitors for the treatment of cancer | 薛定谔公司 | 2023-07-25 | — | — | CN | disclosed |