Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.37 |
| ▸ | TYMP | P19971 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | TACR2 | P21452 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SHBG | P04278 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL991441 | 0.98 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRBGPR35TYMP | |
| SCHEMBL12704406 | 0.80 | GPR35 (0.37) | ALDH1A1TSHRTHRBGPR35TYMP | |
| SCHEMBL12874162 | 0.80 | GPR35 (0.37) | ALDH1A1TSHRTHRBGPR35TYMP | |
| SCHEMBL15477357 | 0.80 | SCD (0.49) | ALDH1A1TSHRESR1HSD17B10 | |
| SCHEMBL5683540 | 0.80 | SCD (0.49) | ALDH1A1TSHRESR1HSD17B10 | |
| SCHEMBL5784377 | 0.77 | NPC1 (0.32) | NPSR1NPC1HPGDMAPK1HTT | |
| SCHEMBL8389921 | 0.77 | NPC1 (0.36) | TYMPNPSR1KDM4ENPC1HPGD | |
| SCHEMBL17353542 | 0.77 | GPR35 (0.56) | ALDH1A1GPR35 | |
| SCHEMBL17008157 | 0.76 | TSHR (0.57) | ALDH1A1TSHRTHRBTYMPESR1 | |
| SCHEMBL9347762 | 0.76 | GPR35 (0.35) | ALDH1A1GPR35TYMP |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8378338-B2 | Conjugated compound, nitrogenated condensed-ring compound, nitrogenated condensed-ring polymer, organic thin film, and organic thin film element | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-02-19 | — | — | US | disclosed |
| EP-2520572-A1 | Nitrogen-containing fused-ring compound, polymer comprising a nitrogen-containing fused-ring repeating unit, organic thin film, and organic thin film element | SUMITOMO CHEMICAL CO., LTD. (JP) | 2012-11-07 | — | — | EP | disclosed |
| US-20120049174-A1 | CONJUGATED COMPOUND, AND ORGANIC THIN FILM AND ORGANIC THIN FILM ELEMENT EACH COMPRISING SAME | OSAKA UNIVERSITY (JP) | 2012-03-01 | — | — | US | disclosed |
| EP-2407465-A1 | CONJUGATED COMPOUND, AND ORGANIC THIN FILM AND ORGANIC THIN FILM ELEMENT EACH COMPRISING SAME | Sumitomo Chemical Company, Limited (JP) | 2012-01-18 | — | — | EP | disclosed |
| US-20100301314-A1 | CONJUGATED COMPOUND, NITROGENATED CONDENSED-RING COMPOUND, NITROGENATED CONDENSED-RING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM ELEMENT | OSAKA UNIVERSITY (JP) | 2010-12-02 | — | — | US | disclosed |
| EP-2223918-A1 | CONJUGATED COMPOUND, NITROGENATED CONDENSED-RING COMPOUND, NITROGENATED CONDENSED-RING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM ELEMENT | Osaka University (JP) | 2010-09-01 | — | — | EP | 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-20120049174-A1 | CONJUGATED COMPOUND, AND ORGANIC THIN FILM AND ORGANIC THIN FILM ELEMENT EACH COMPRISING SAME | AHR, C9, C5 | ALDH1A1 1342/4885TSHR 582/4885THRB 1066/4885 |
| US-20100301314-A1 | CONJUGATED COMPOUND, NITROGENATED CONDENSED-RING COMPOUND, NITROGENATED CONDENSED-RING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM ELEMENT | F12, F9, C9 | ALDH1A1 2798/4885TSHR 1396/4885THRB 1027/4885 |
“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.