Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.51 |
| ▸ | PIM1 | P11309 | 4/20 | 0.49 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.49 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | AKT1 | P31749 | 2/20 | 0.43 |
| ▸ | AKT2 | P31751 | 2/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL473704 | 0.83 | ADORA2A (0.45) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL18876259 | 0.78 | CYP2A6 (0.64) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL29576461 | 0.78 | MAP4K4 (0.59) | CYP2A6CYP3A4MAP4K4HSP90AA1HSP90AB1 | |
| SCHEMBL3949315 | 0.78 | MAP4K4 (0.59) | CYP2A6CYP3A4MAP4K4HSP90AA1HSP90AB1 | |
| SCHEMBL26301732 | 0.77 | CYP2A6 (0.54) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL14689056 | 0.77 | CYP2A6 (0.58) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL27608932 | 0.72 | CYP2A6 (0.50) | CYP2A6CYP3A4MAP4K4HSP90AA1HSP90AB1 | |
| SCHEMBL12435508 | 0.71 | CYP2A6 (0.58) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL19554650 | 0.71 | CYP2A6 (0.50) | CYP2A6PIM1PIM3PIM2CYP3A4 | |
| SCHEMBL972625 | 0.70 | NUDT1 (0.53) | CYP2A6CYP3A4HSP90AA1HSP90AB1PTK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120208809-A1 | 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-08-16 | — | — | 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-20120208809-A1 | 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | NPR3, CCNH, CBR3 | CYP2A6 1471/4885PIM1 3366/4885PIM3 1252/4885 |
“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.