Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TACR1 | P25103 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 2/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5722244 | 0.91 | TSHR (0.47) | TSHRTACR1LMNADHFRIDO1 | |
| SCHEMBL15043681 | 0.86 | TACR1 (0.45) | TSHRTACR1LTA4HCHRM2CHRM1 | |
| SCHEMBL4208040 | 0.84 | TACR1 (0.44) | TSHRTACR1LMNALTA4H | |
| SCHEMBL3490325 | 0.84 | TSHR (0.47) | TSHRTACR1LMNACHRM2CHRM1 | |
| SCHEMBL19074506 | 0.84 | TSHR (0.47) | TSHRTACR1LTA4HIDO1 | |
| SCHEMBL15042326 | 0.82 | TACR1 (0.42) | TSHRTACR1LMNACHRM1CHRM3 | |
| SCHEMBL14697067 | 0.81 | TSHR (0.48) | TSHRTACR1LMNADHFRCHRM2 | |
| SCHEMBL15043710 | 0.81 | TSHR (0.48) | TSHRTACR1IDO1CHRM2CHRM1 | |
| SCHEMBL16372159 | 0.81 | TSHR (0.48) | TSHRTACR1LMNADHFRLTA4H | |
| SCHEMBL6555217 | 0.81 | TSHR (0.52) | TSHRTACR1IDO1CHRM2CHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3119739-A1 | LOW-PRESSURE SYNTHESIS OF CYCLOHEXANEDIMETHANOL AND DERIVATIVES | Eastman Chemical Company (US) | 2017-01-25 | — | — | EP | disclosed |
| WO-2015142549-A1 | LOW-PRESSURE SYNTHESIS OF CYCLOHEXANEDIMETHANOL AND DERIVATIVES | EASTMAN CHEMICAL COMPANY (US) | 2015-09-24 | — | — | WO | disclosed |