Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 7/20 | 0.48 |
| ▸ | CD44 | P16070 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NCF1 | P14598 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.38 |
| ▸ | PIK3C2B | O00750 | 2/20 | 0.38 |
| ▸ | MTOR | P42345 | 2/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24913864 | 0.88 | CYP2A13 (0.53) | CYP2A13CYP2C9ALOX15HSD17B10CXCR4 | |
| Hydrochloric Acid SCHEMBL29008593 | 0.87 | CYP2A13 (0.51) | CYP2A13CYP2C9ALOX15HSD17B10CXCR4 | |
| Hydrochloric Acid SCHEMBL30368364 | 0.87 | CYP2A13 (0.51) | CYP2A13CYP2C9ALOX15HSD17B10CXCR4 | |
| SCHEMBL21646423 | 0.77 | CYP2A13 (0.50) | CYP2A13CYP2C9ALOX15HSD17B10CXCR4 | |
| SCHEMBL21744251 | 0.76 | KDM4E (0.49) | CD44CYP2C9ALOX15HSD17B10ALDH1A1 | |
| SCHEMBL21744253 | 0.76 | HRH3 (0.56) | KDM4EHRH3CYP2D6 | |
| SCHEMBL21744257 | 0.76 | PIK3CD (0.43) | CD44KDM4EMEN1KMT2ACYP3A4 | |
| SCHEMBL1011153 | 0.75 | CD44 (0.49) | CD44CYP2C9ALOX15HSD17B10ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5778782 | 0.74 | KDM4E (0.41) | CD44ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL24913969 | 0.74 | HTR6 (0.49) | ALDH1A1KDM4ECYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230112832-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | UNIV EMORY (US) | 2023-04-13 | — | — | US | disclosed |
| US-20200054623-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | EMORY UNIVERSITY | 2020-02-20 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20200054623-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | CXCR4, CXCL12, CXCR1 | CYP2A13 4545/4885CD44 407/4885CYP2C9 4817/4885 |
| US-20230112832-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | CXCR4, CXCL12, CXCR1 | CYP2A13 4545/4885CD44 407/4885CYP2C9 4817/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.