Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD5 | P21918 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL3269864 | 0.86 | ESR1 (0.61) | ESR1ESR2CHRNA7DRD2DRD4 | |
| SCHEMBL30513304 | 0.86 | ESR1 (0.61) | ESR1ESR2CHRNA7DRD2DRD4 | |
| SCHEMBL5547664 | 0.81 | BRD4 (0.55) | ESR1ESR2CHRNA7 | |
| SCHEMBL6499654 | 0.80 | ESR2 (0.68) | ESR1ESR2CHRNA7DRD2DRD1 | |
| SCHEMBL10262750 | 0.80 | CREBBP (0.41) | ESR1ESR2CHRNA7 | |
| SCHEMBL19889286 | 0.79 | PBRM1 (0.45) | ESR1ESR2CHRNA7 | |
| SCHEMBL28011773 | 0.79 | ESR1 (0.61) | ESR1ESR2CHRNA7DRD2DRD1 | |
| SCHEMBL27946028 | 0.79 | ESR1 (0.61) | ESR1ESR2CHRNA7DRD2DRD1 | |
| SCHEMBL27706404 | 0.79 | ESR1 (0.61) | ESR1ESR2CHRNA7DRD2DRD1 | |
| SCHEMBL9748059 | 0.78 | ESR1 (0.56) | ESR1ESR2CHRNA7 |
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-9828407-B2 | Water soluble and activable phenolic derivatives with dermocosmetic and therapeutic applications and process for preparing said derivatives | LIBRAGEN (FR) | 2017-11-28 | — | — | US | disclosed |
| EP-2953938-A1 | FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF | Novogen Ltd. (AU) | 2015-12-16 | — | — | EP | disclosed |
| WO-2015117202-A1 | FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF | NOVOGEN LIMITED (AU) | 2015-08-13 | — | — | WO | disclosed |
| EP-0230475-B1 | NOVEL UREA DERIVATIVES, PROCESSES FOR PRODUCTION THEREOF AND HERBICIDE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-03-18 | — | — | EP | disclosed |
| US-4838924-A | NONPHYTOTOXIC | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-06-13 | — | — | US | disclosed |
| US-4391821-A | HYPOTENSIVE AGENTS, ADRENERGIC BLOCKING AGENTS, ANTIARRHYTHMIA AGENTS | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) | 1983-07-05 | — | — | US | disclosed |