Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4523137 | 0.85 | CYP1A2 (0.52) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL2299694 | 0.84 | TACR1 (0.48) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL15599302 | 0.81 | CYP1A2 (1.00) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL29903072 | 0.80 | CYP1A2 (0.60) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL242241 | 0.74 | TACR1 (0.71) | CYP2C9ALDH1A1RAB9ATACR1TP53 | |
| SCHEMBL242242 | 0.74 | TACR1 (0.71) | CYP2C9ALDH1A1RAB9ATACR1TP53 | |
| SCHEMBL25412903 | 0.73 | CYP1A2 (0.64) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| Acetic Acid SCHEMBL27445733 | 0.73 | TACR1 (0.69) | CYP2C9ALDH1A1RAB9ATACR1TP53 | |
| SCHEMBL22775670 | 0.73 | NLRP3 (0.41) | CYP1A2CYP2C9HIF1ATACR1ACACB | |
| SCHEMBL29702242 | 0.73 | NLRP3 (0.41) | CYP1A2CYP2C9HIF1ATACR1ACACB |
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 |
|---|---|---|---|---|---|---|---|
| US-20050080263-A1 | Method for producing ss-heteroaryl-alpha-alanine compounds using 2-amino-2-(heteroarylmethyl) carboxylic acid compounds | CHIRACON GMBH (DE) | 2005-04-14 | — | — | US | claimed |
| US-7626022-B2 | Racemic mixtures; oxidation; cyclization; crystallization | CHIRACON GMBH (DE) | 2009-12-01 | — | — | US | disclosed |
| US-20050080263-A1 | Method for producing ss-heteroaryl-alpha-alanine compounds using 2-amino-2-(heteroarylmethyl) carboxylic acid compounds | CHIRACON GMBH (DE) | 2005-04-14 | — | — | 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-20050080263-A1 | Method for producing ss-heteroaryl-alpha-alanine compounds using 2-amino-2-(heteroarylmethyl) carboxylic acid compounds | AAAS, ASNS, AADAT | CYP1A2 95/4885CYP2C9 120/4885HIF1A 3789/4885 |
“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.