Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NDUFS8 | O00217 | 1/20 | 0.30 |
| ▸ | COXFA4 | O00483 | 1/20 | 0.30 |
| ▸ | NDUFAB1 | O14561 | 1/20 | 0.30 |
| ▸ | NDUFA1 | O15239 | 1/20 | 0.30 |
| ▸ | NDUFS4 | O43181 | 1/20 | 0.30 |
| ▸ | NDUFB5 | O43674 | 1/20 | 0.30 |
| ▸ | NDUFB3 | O43676 | 1/20 | 0.30 |
| ▸ | NDUFC1 | O43677 | 1/20 | 0.30 |
| ▸ | NDUFA2 | O43678 | 1/20 | 0.30 |
| ▸ | NDUFS5 | O43920 | 1/20 | 0.30 |
| ▸ | NDUFS7 | O75251 | 1/20 | 0.30 |
| ▸ | NDUFS2 | O75306 | 1/20 | 0.30 |
| ▸ | NDUFS6 | O75380 | 1/20 | 0.30 |
| ▸ | NDUFB1 | O75438 | 1/20 | 0.30 |
| ▸ | NDUFS3 | O75489 | 1/20 | 0.30 |
| ▸ | NDUFB6 | O95139 | 1/20 | 0.30 |
| ▸ | NDUFA3 | O95167 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11800702 | 0.83 | TSHR (0.53) | TSHRALDH1A1NDUFS8COXFA4NDUFAB1 | |
| SCHEMBL11804538 | 0.83 | TSHR (0.53) | TSHRALDH1A1NDUFS8COXFA4NDUFAB1 | |
| SCHEMBL24261133 | 0.76 | TSHR (0.43) | TSHRALDH1A1TP53 | |
| SCHEMBL9017102 | 0.76 | TSHR (0.43) | TSHRALDH1A1TP53 | |
| SCHEMBL11412050 | 0.75 | HSD17B10 (0.32) | NDUFS8COXFA4NDUFAB1NDUFA1NDUFS4 | |
| SCHEMBL15316377 | 0.74 | NDUFS8 (0.36) | NDUFS8COXFA4NDUFAB1NDUFA1NDUFS4 | |
| SCHEMBL8531998 | 0.74 | HSD17B10 (0.32) | — | |
| SCHEMBL1583127 | 0.73 | — | — | |
| SCHEMBL5521542 | 0.73 | NDUFS8 (0.35) | NDUFS8COXFA4NDUFAB1NDUFA1NDUFS4 | |
| SCHEMBL5521538 | 0.73 | NDUFS8 (0.35) | NDUFS8COXFA4NDUFAB1NDUFA1NDUFS4 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-11279103-A | — | — | None | — | — | JP | disclosed |
| JP-H11279103-A | PRODUCTION OF UNSATURATED CARBOXYLIC ACID ESTER AND PRODUCTION OF BETA-SINENSAL BY USING THE UNSATURATED CARBOXYLIC ACID ESTER AS INTERMEDIATE | SODA AROMATIC CO LTD | 1999-10-12 | — | — | JP | disclosed |
| EP-0024095-B1 | TOTAL SYNTHESIS OF (1RS, 4SR, 5RS)-4-(4,8-DIMETHYL-5-HYDROXY-7-NONENYL)-4-METHYL-3,8-DIOXABICYCLO (3.2.1) OCTANE-1-ACETIC ACID AND INTERMEDIATES | ORTHO PHARMACEUTICAL CORPORATION (US) | 1984-09-26 | — | — | EP | disclosed |
| EP-0024095-A1 | Total synthesis of (1RS, 4SR, 5RS)-4-(4,8-dimethyl-5-hydroxy-7-nonenyl)-4-methyl-3,8-dioxabicyclo (3.2.1) octane-1-acetic acid and intermediates | ORTHO PHARMACEUTICAL CORPORATION (US) | 1981-02-25 | — | — | EP | disclosed |
| US-4215048-A | Total synthesis of (1RS, 4SR, 5RS)-4-(4,8-dimethyl-5-hydroxy-7-nonenyl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-acetic acid | ORTHO PHARMACEUTICAL CORPORATION (US) | 1980-07-29 | — | — | US | disclosed |
| US-4031161-A | Process for producing mixture containing 4-(4'-methyl-4'-hydroxyamyl)-Δ3 -cyclohexene carboxaldehyde | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-06-21 | — | — | US | disclosed |
| US-4007137-A | Process for producing mixture containing 4-(4-methyl-4-hydroxyamyl)Δ3 -cyclohexenecarboxaldehyde, product produced, and its perfume uses | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-02-08 | — | — | US | disclosed |
| US-3947505-A | 1-Halo-dodeca-tri(tetra)-ene | GIVAUDAN CORPORATION (US) | 1976-03-30 | — | — | US | disclosed |
| US-3943177-A | Compounds of the sinensal type, intermediates and process therefor | GIVAUDAN CORPORATION (US) | 1976-03-09 | — | — | US | disclosed |