Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15128324 | 0.81 | ALDH1A1 (0.38) | NLRP3ALDH1A1LMNAHSD17B10MAPT | |
| SCHEMBL8333602 | 0.79 | NLRP3 (0.39) | NLRP3ALDH1A1LMNAHSD17B10MAPT | |
| SCHEMBL16470985 | 0.79 | NLRP3 (0.36) | NLRP3ALDH1A1LMNAHSD17B10CYP3A4 | |
| SCHEMBL13031121 | 0.78 | NLRP3 (0.38) | NLRP3ALDH1A1LMNAHSD17B10 | |
| SCHEMBL8836034 | 0.78 | NLRP3 (0.38) | NLRP3ALDH1A1LMNAHSD17B10CA12 | |
| SCHEMBL1738333 | 0.77 | NLRP3 (0.37) | NLRP3ALDH1A1HSD17B10MAPTCYP3A4 | |
| SCHEMBL1738334 | 0.77 | NLRP3 (0.37) | NLRP3ALDH1A1HSD17B10MAPTCYP3A4 | |
| SCHEMBL5485344 | 0.77 | NLRP3 (0.37) | NLRP3ALDH1A1HSD17B10MAPTCYP3A4 | |
| SCHEMBL8472968 | 0.74 | NLRP3 (0.36) | NLRP3LMNAKMT2A | |
| SCHEMBL8447099 | 0.74 | NLRP3 (0.36) | NLRP3LMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015142549-A1 | LOW-PRESSURE SYNTHESIS OF CYCLOHEXANEDIMETHANOL AND DERIVATIVES | EASTMAN CHEMICAL COMPANY (US) | 2015-09-24 | — | — | WO | disclosed |
| US-9115155-B1 | Low-pressure synthesis of cyclohexanedimethanol and derivatives | EASTMAN CHEMICAL COMPANY (US) | 2015-08-25 | — | — | US | disclosed |
| US-9115155-B1 | Low-pressure synthesis of cyclohexanedimethanol and derivatives | EASTMAN CHEMICAL COMPANY (US) | 2015-08-25 | — | — | US | disclosed |