Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 15/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2982908 | 0.93 | MCHR1 (0.50) | MCHR1POLBSIGMAR1KCNH2 | |
| SCHEMBL2976726 | 0.91 | MCHR1 (0.54) | MCHR1POLBSIGMAR1 | |
| SCHEMBL2987754 | 0.89 | POLB (0.50) | POLBSIGMAR1 | |
| SCHEMBL2983707 | 0.88 | POLB (0.53) | MCHR1POLBSIGMAR1 | |
| SCHEMBL2972810 | 0.87 | ATF4 (0.55) | MCHR1POLBSIGMAR1 | |
| SCHEMBL2987366 | 0.87 | MCHR1 (0.54) | MCHR1POLBKCNH2 | |
| SCHEMBL5162561 | 0.86 | ALDH1A1 (0.40) | POLBSIGMAR1 | |
| SCHEMBL2978691 | 0.83 | MCHR1 (0.51) | MCHR1POLB | |
| SCHEMBL2972824 | 0.83 | ATF4 (0.59) | MCHR1POLB | |
| SCHEMBL2987178 | 0.82 | ATF4 (0.58) | MCHR1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007536322-A | — | — | 2007-12-13 | — | — | JP | claimed |
| EP-1747191-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION | Grünenthal GmbH (DE) | 2007-01-31 | — | — | EP | claimed |
| WO-2005110975-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION | Grünenthal GmbH (DE) | 2005-11-24 | — | — | WO | claimed |