Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CCR2 | P41597 | 8/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CCR5 | P51681 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CPB1 | P15086 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5030519 | 0.95 | CCR2 (0.53) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5033696 | 0.86 | CCR2 (0.61) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5033692 | 0.86 | CCR2 (0.61) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5029290 | 0.86 | ALDH1A1 (0.49) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5029280 | 0.86 | ALDH1A1 (0.49) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5030442 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5030435 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CCR2CYP2D6KCNH2CYP3A4 | |
| SCHEMBL5027183 | 0.83 | ALDH1A1 (0.57) | ALDH1A1CCR2CYP3A4TSHRCPB1 | |
| SCHEMBL5027188 | 0.83 | ALDH1A1 (0.57) | ALDH1A1CCR2CYP3A4TSHRCPB1 | |
| SCHEMBL5030522 | 0.79 | CCR2 (0.44) | CCR2CYP2D6KCNH2CCR5CPB1 |
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-7378409-B2 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-27 | — | — | US | disclosed |
| US-20050054626-A1 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY | 2005-03-10 | — | — | 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 (1 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-20050054626-A1 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | CCL11, CCR1, CCR2 | ALDH1A1 827/4885CCR2 3/4885CYP2D6 3033/4885 |
“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.