Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.72 |
| ▸ | HTT | P42858 | 3/20 | 0.72 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.51 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.51 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.51 |
| ▸ | CFTR | P13569 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28142999 | 0.94 | ALDH1A1 (0.64) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL2602407 | 0.91 | ALDH1A1 (0.72) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL28283489 | 0.89 | ALDH1A1 (0.65) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL28142270 | 0.85 | ALDH1A1 (0.56) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL8025343 | 0.85 | HTT (0.58) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL804992 | 0.85 | ESR2 (0.73) | ALDH1A1HTTPKMRAB9AESR1 | |
| SCHEMBL2326368 | 0.85 | ALDH1A1 (0.63) | ALDH1A1HTTRXFP1PKMRAB9A | |
| SCHEMBL10041513 | 0.83 | ESR2 (0.71) | ALDH1A1HTTPKMRAB9AESR1 | |
| SCHEMBL16692234 | 0.83 | ESR2 (0.71) | ALDH1A1HTTPKMRAB9AESR1 | |
| SCHEMBL23336889 | 0.83 | ALDH1A1 (0.66) | ALDH1A1HTTRXFP1PKMRAB9A |
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-20210130382-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME | LG DISPLAY CO., LTD. (KR) | 2021-05-06 | — | — | US | disclosed |
| CN-104557725-B | A kind of method of the diaryl benzimidazole of one pot process 1,2 and its derivative | 江苏先科药业有限公司 | 2017-06-30 | — | — | CN | disclosed |
| US-8362019-B2 | Synthesis and anti-proliferative effect of substituted imidazo[4,5-b]pyrazine compounds | SPELMAN COLLEGE (US) | 2013-01-29 | — | — | US | disclosed |
| US-20120095009-A1 | SYNTHESIS AND ANTI-PROLIFERATIVE EFFECT OF BENZIMIDAZOLE DERIVATIVES | SPELMAN COLLEGE (US) | 2012-04-19 | — | — | 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-20210130382-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME | DDT, ORC3, PPOX | ALDH1A1 195/4885HTT 3669/4885RXFP1 4815/4885 |
| US-20120095009-A1 | SYNTHESIS AND ANTI-PROLIFERATIVE EFFECT OF BENZIMIDAZOLE DERIVATIVES | MKI67, CCNI, TYMP | ALDH1A1 1026/4885HTT 4534/4885RXFP1 4777/4885 |
“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.