Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.53 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8672850 | 0.91 | PTGS2 (0.59) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL9515947 | 0.81 | PTGS2 (0.54) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL425178 | 0.79 | TLR8 (0.54) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL15956232 | 0.79 | PTGS2 (0.57) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL7264640 | 0.79 | PTGS2 (0.53) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL10144166 | 0.78 | ALDH1A1 (0.47) | HPGDSOAT1S100A4NPC1RAB9A | |
| SCHEMBL19002781 | 0.78 | PTGS2 (0.51) | PTGS2TLR8HPGDSOAT1S100A4 | |
| SCHEMBL6039974 | 0.78 | HTR7 (0.59) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL28327301 | 0.78 | PTGS2 (0.51) | PTGS2TLR8SOAT1S100A4NPC1 | |
| SCHEMBL2974208 | 0.78 | PTGS2 (0.51) | PTGS2TLR8SOAT1S100A4NPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019025156-A1 | SUBSTITUTED PYRROLIDINONES, SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2019-02-07 | — | — | WO | disclosed |
| US-9481645-B2 | Composition, synthesis, and use of a new class of isonitriles | DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) | 2016-11-01 | — | — | US | disclosed |
| US-9481645-B2 | Composition, synthesis, and use of a new class of isonitriles | DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) | 2016-11-01 | — | — | US | disclosed |
| US-20150239835-A1 | COMPOSITION, SYNTHESIS, AND USE OF A NEW CLASS OF ISONITRILES | DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) | 2015-08-27 | — | — | US | disclosed |
| US-20150239835-A1 | COMPOSITION, SYNTHESIS, AND USE OF A NEW CLASS OF ISONITRILES | DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) | 2015-08-27 | — | — | 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-20150239835-A1 | COMPOSITION, SYNTHESIS, AND USE OF A NEW CLASS OF ISONITRILES | CYP3A4, UGT1A4, INTS9 | PTGS2 3479/4885TLR8 4757/4885HPGD 2051/4885 |
“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.