Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | TRPM8 | Q7Z2W7 | 10/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6538743 | 0.89 | NPC1 (0.52) | NPC1RAB9AALDH1A1TRPM8 | |
| SCHEMBL6539259 | 0.86 | ALDH1A1 (0.50) | NPC1RAB9AALDH1A1TRPM8 | |
| SCHEMBL6538464 | 0.85 | SMN1; SMN2 (0.61) | NPC1RAB9AALDH1A1 | |
| SCHEMBL11320951 | 0.84 | ALDH1A1 (0.48) | NPC1RAB9AALDH1A1TRPM8 | |
| SCHEMBL5157418 | 0.84 | ALDH1A1 (0.48) | NPC1RAB9AALDH1A1TRPM8 | |
| SCHEMBL6539644 | 0.82 | SRD5A2 (0.60) | NPC1RAB9AALDH1A1 | |
| SCHEMBL23358696 | 0.81 | POLB (0.69) | NPC1RAB9ATRPM8 | |
| SCHEMBL4010768 | 0.81 | TRPM8 (0.67) | NPC1RAB9ATRPM8 | |
| SCHEMBL2211541 | 0.81 | NPC1 (0.67) | NPC1RAB9ATRPM8 | |
| SCHEMBL1948207 | 0.81 | GAA (0.64) | NPC1RAB9AALDH1A1 |
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-6812235-B2 | 2-ACYLAMINO- BETA -ALANINE DERIVATIVES AND A PHARMACEUTICALLY ACCEPTABLE SALT, USEFUL AS FIBRINOGEN RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-11-02 | — | — | US | disclosed |
| US-20030018193-A1 | Beta-alanine derivatives and their use as receptor anatgonists | ASTELLAS PHARMA INC. (JP) | 2003-01-23 | — | — | 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-20030018193-A1 | Beta-alanine derivatives and their use as receptor anatgonists | ARRB1, ADRB1, GLRB | NPC1 1562/4885RAB9A 943/4885ALDH1A1 578/4885 |
“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.