Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.35 |
| ▸ | PPARG | P37231 | 7/20 | 0.35 |
| ▸ | PPARD | Q03181 | 7/20 | 0.35 |
| ▸ | PPARA | Q07869 | 7/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TLR2 | O60603 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | FABP4 | P15090 | 2/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL4881617 | 0.98 | MEN1 (0.34) | MEN1KMT2AFAAHTP53CYP1A2 | |
| Ethoxycarbonyl Group SCHEMBL4428871 | 0.90 | ALOX15 (0.32) | ALOX15 | |
| Ethoxycarbonyl Group SCHEMBL11691061 | 0.89 | ALOX15 (0.35) | ALDH1A1ALOX15 | |
| Ethoxycarbonyl Group SCHEMBL4879176 | 0.87 | ALOX15 (0.33) | ALOX15 | |
| Ethoxycarbonyl Group SCHEMBL4877557 | 0.87 | ALOX15 (0.33) | ALOX15 | |
| Hexyl Formate SCHEMBL4879088 | 0.86 | CA1 (0.41) | — | |
| Benzene SCHEMBL4437867 | 0.85 | ALOX15 (0.32) | ALOX15 | |
| Heptane SCHEMBL25434047 | 0.85 | TSHR (0.48) | FAAHTSHRALDH1A1EPHX1ADH1B | |
| Nonane SCHEMBL27721173 | 0.85 | TSHR (0.48) | FAAHTSHRALDH1A1EPHX1ADH1B | |
| Octane SCHEMBL27662967 | 0.85 | TSHR (0.48) | FAAHTSHRALDH1A1EPHX1ADH1B |
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 |
|---|---|---|---|---|---|---|---|
| US-6315925-B1 | USED AS ADDITIVE FOR STABILISING ORGANIC PRODUCTS THAT ARE SUBJECTED TO OXIDATIVE, THERMAL AND/OR LIGHT-INDUCED DEGRADATION | CIBA SPECIALTY CHEMICALS CORPORATION | 2001-11-13 | — | — | US | disclosed |
| US-5672574-A | Stabilizers for organic materials | CIBA-GEIGY CORPORATION (US) | 1997-09-30 | — | — | US | disclosed |