Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Nelivaptan. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1B known ✓ | P47901 | 20/20 | 1.00 |
| ▸ | AVPR1A | P37288 | 11/20 | 1.00 |
| ▸ | OXTR | P30559 | 11/20 | 1.00 |
| ▸ | AVPR2 | P30518 | 3/20 | 1.00 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 1.00 |
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 | |
|---|---|---|---|---|
| Nelivaptan SCHEMBL14517029 | 1.00 | AVPR1B (1.00) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| Nelivaptan SCHEMBL29380118 | 1.00 | AVPR1B (1.00) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| Nelivaptan SCHEMBL2798065 | 1.00 | AVPR1B (1.00) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| Nelivaptan SCHEMBL4307280 | 1.00 | AVPR1B (1.00) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| Nelivaptan SCHEMBL31317579 | 0.97 | AVPR1B (0.95) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| SCHEMBL5351446 | 0.95 | AVPR1B (0.91) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| SCHEMBL5347025 | 0.95 | AVPR1B (0.90) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| SCHEMBL7403029 | 0.95 | AVPR1B (0.90) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| SCHEMBL7408252 | 0.95 | AVPR1B (0.90) | AVPR1BAVPR1AOXTRAVPR2GPR65 | |
| SCHEMBL5351285 | 0.95 | AVPR1B (0.90) | AVPR1BAVPR1AOXTRAVPR2GPR65 |
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-7297692-B2 | 1,3-dihydro-2H-indol-2-one derivatives, process for preparing them and pharmaceutical compositions containing them | SANOFI-AVENTIS (FR) | 2007-11-20 | — | — | US | disclosed |
| US-20070004703-A1 | NOVEL 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SANOFI-AVENTIS (FR) | 2007-01-04 | — | — | US | disclosed |
| US-7129240-B2 | 1,3-dihydro-2H-indol-2one derivatives, process for preparing them and pharmaceutical compositions containing them | SANOFI-AVENTIS (FR) | 2006-10-31 | — | — | US | disclosed |
| US-20040209938-A1 | Novel 1,3-dihydro-2H-indol-2one derivatives, process for preparing them and pharmaceutical compositions containing them | SANOFI (FR) | 2004-10-21 | — | — | US | disclosed |
| US-6730695-B2 | TREATMENT OF HYPERTENSION, CENTRAL NERVOUS SYSTEM DISORDERS | SANOFI-SYNTHELABO (FR) | 2004-05-04 | — | — | US | disclosed |
| US-20030114683-A1 | Novel 1,3-dihydro-2h-indol-2-one derivatives and their use as ligands for v1b and v1a arginine-vasopressin receptors | SANOFI (FR) | 2003-06-19 | — | — | 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 (3 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-20030114683-A1 | Novel 1,3-dihydro-2h-indol-2-one derivatives and their use as ligands for v1b and v1a arginine-vasopressin receptors | AVPR1B, AVPR1A, AVPR2 | AVPR1B 1/4885AVPR1A 2/4885OXTR 7/4885 |
| US-20040209938-A1 | Novel 1,3-dihydro-2H-indol-2one derivatives, process for preparing them and pharmaceutical compositions containing them | AVPR2, AVPR1B, AVPR1A | AVPR1B 2/4885AVPR1A 3/4885OXTR 16/4885 |
| US-20070004703-A1 | NOVEL 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | AVPR1B, AVPR2, AVPR1A | AVPR1B 1/4885AVPR1A 3/4885OXTR 6/4885 |
“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.