Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.45 |
| ▸ | AGXT | P21549 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL14346666 | 0.78 | CYP1A2 (0.52) | CYP1A2CYP2A6TAAR1KCNH2AGXT | |
| SCHEMBL19036563 | 0.77 | CYP1A2 (0.56) | CYP1A2CYP2A6TAAR1IDO1TDP1 | |
| SCHEMBL31398273 | 0.76 | TAAR1 (0.56) | CYP2A6TAAR1IDO1NPC1CYP3A4 | |
| SCHEMBL15384438 | 0.76 | ESR1 (0.59) | TAAR1IDO1TDP1L3MBTL1NPC1 | |
| SCHEMBL11086271 | 0.76 | CYP1A2 (0.50) | CYP1A2CYP2A6TAAR1KCNH2AGXT | |
| SCHEMBL143961 | 0.76 | CYP1A2 (0.68) | CYP1A2CYP2A6TAAR1KCNH2AGXT | |
| SCHEMBL11288839 | 0.76 | CYP1A2 (0.68) | CYP1A2CYP2A6TAAR1KCNH2AGXT | |
| SCHEMBL22101172 | 0.76 | TAAR1 (0.61) | TAAR1AGXTIDO1ALDH1A1 | |
| SCHEMBL2468970 | 0.75 | IDO1 (0.56) | CYP1A2CYP2A6TAAR1AGXTIDO1 | |
| SCHEMBL14702015 | 0.74 | CYP1A2 (0.48) | CYP1A2CYP2A6TAAR1KCNH2AGXT |
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-11078188-B2 | Dihydroquinoxaline bromodomain recognition protein inhibitor, preparation method and use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2021-08-03 | — | — | US | disclosed |
| US-20200031802-A1 | DIHYDROQUINOXALINE BROMODOMAIN RECOGNITION PROTEIN INHIBITOR, PREPARATION METHOD AND USE THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2020-01-30 | — | — | 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-20200031802-A1 | DIHYDROQUINOXALINE BROMODOMAIN RECOGNITION PROTEIN INHIBITOR, PREPARATION METHOD AND USE THEREOF | BRD4, BRPF3, BRD1 | CYP1A2 3910/4885CYP2A6 2732/4885TAAR1 3307/4885 |
| US-11078188-B2 | Dihydroquinoxaline bromodomain recognition protein inhibitor, preparation method and use thereof | BRD4, BRPF3, BRD1 | CYP1A2 3910/4885CYP2A6 2732/4885TAAR1 3307/4885 |
“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.