Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 18/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11589870 | 0.86 | VCAM1 (0.67) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL11456478 | 0.82 | ALPL (0.63) | VCAM1ALDH1A1 | |
| SCHEMBL29196117 | 0.82 | VCAM1 (0.45) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL30741202 | 0.82 | VCAM1 (0.45) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL9574404 | 0.81 | VCAM1 (0.47) | VCAM1ALDH1A1 | |
| SCHEMBL30813055 | 0.81 | VCAM1 (0.69) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL1097803 | 0.81 | VCAM1 (0.69) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL809482 | 0.80 | VCAM1 (0.73) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL10452716 | 0.80 | VCAM1 (0.73) | VCAM1ALDH1A1NPBWR1MCHR1 | |
| SCHEMBL29780388 | 0.80 | VCAM1 (0.73) | VCAM1ALDH1A1NPBWR1MCHR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0342532-B1 | PROCESS FOR THE PREPARATION OF 4-CHLORO-2-METHYL-5-NITRO-PHENOL | Wella Aktiengesellschaft (DE) | 1993-01-07 | — | — | EP | claimed |
| US-4960955-A | Process for making 4-chloro-2-methyl-5-nitro-phenol | WELLA AKTIENGESELLSCHAFT (DE) | 1990-10-02 | — | — | US | disclosed |
| US-4960955-A | Process for making 4-chloro-2-methyl-5-nitro-phenol | WELLA AKTIENGESELLSCHAFT (DE) | 1990-10-02 | — | — | US | disclosed |
| EP-0342532-A1 | Process for the preparation of 4-chloro-2-methyl-5-nitro-phenol | Wella Aktiengesellschaft (DE) | 1989-11-23 | — | — | EP | disclosed |