Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 11/20 | 0.38 |
| ▸ | KIT | P10721 | 10/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL827495 | 0.90 | CYP1A2 (0.43) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827578 | 0.90 | CYP1A2 (0.41) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827764 | 0.86 | CYP1A2 (0.39) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827982 | 0.85 | CYP1A2 (0.39) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827698 | 0.81 | CYP1A2 (0.41) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827727 | 0.81 | CYP1A2 (0.42) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL12450325 | 0.80 | CYP1A2 (0.42) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL2343141 | 0.80 | ADORA3 (0.41) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL827668 | 0.77 | CYP1A2 (0.38) | CYP1A2ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL2340465 | 0.77 | CYP1A2 (0.39) | CYP1A2ADORA3ADORA2AADORA2BADORA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8143419-B2 | Trisubstituted 1,2,4-triazoles | JANSSEN PHARMACEUTICA N. V. (BE) | 2012-03-27 | — | — | US | disclosed |
| US-8143419-B2 | Trisubstituted 1,2,4-triazoles | JANSSEN PHARMACEUTICA N. V. (BE) | 2012-03-27 | — | — | US | disclosed |
| US-20090253691-A1 | TRISUBSTITUTED 1,2,4-TRIAZOLES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-10-08 | — | — | US | disclosed |
| US-20090253691-A1 | TRISUBSTITUTED 1,2,4-TRIAZOLES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-10-08 | — | — | 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-20090253691-A1 | TRISUBSTITUTED 1,2,4-TRIAZOLES | CHRNA1, CHRNA5, CHRNA3 | CYP1A2 438/4885ADORA3 31/4885ADORA2A 38/4885 |
“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.