Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.68 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | DRD3 | P35462 | 2/20 | 0.68 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.68 |
| ▸ | SLCO1B1 | Q9Y6L6 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.62 |
| ▸ | APP | P05067 | 4/20 | 0.62 |
| ▸ | SNCA | P37840 | 4/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.60 |
| ▸ | RXRA | P19793 | 5/20 | 0.60 |
| ▸ | RARA | P10276 | 4/20 | 0.60 |
| ▸ | RARB | P10826 | 4/20 | 0.60 |
| ▸ | RARG | P13631 | 4/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL11065288 | 1.00 | ALDH1A1 (0.68) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL11600758 | 0.84 | ALDH1A1 (0.94) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL11417176 | 0.84 | ALDH1A1 (0.94) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL11780848 | 0.83 | ALDH1A1 (0.65) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL11780842 | 0.83 | ALDH1A1 (0.65) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL6896309 | 0.83 | CYP1A2 (0.53) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL6896312 | 0.83 | CYP1A2 (0.53) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| SCHEMBL8472740 | 0.82 | ALDH1A1 (0.80) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| Beta Carotene SCHEMBL6466298 | 0.82 | ALDH1A1 (0.94) | ALDH1A1PTGS1LMNADRD3SLCO1B3 | |
| Beta Carotene SCHEMBL6151 | 0.82 | ALDH1A1 (1.00) | ALDH1A1PTGS1LMNADRD3SLCO1B3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4474983-A | Process for preparing compounds having a 1,5-dimethyl-hexa-1,5-dienylene group by desulphonylation of a corresponding sulphone | RHONE-POULENC S.A. (FR) | 1984-10-02 | — | — | US | disclosed |
| US-4433171-A | Sulphones having a 1,5-dimethyl-hexa-1,5-dienylene group | RHONE-POULENC S.A. (FR) | 1984-02-21 | — | — | US | disclosed |
| US-4331814-A | Sulphones having a 1,5-dimethyl-hexa-1,5-dienylene group | RHONE POULENC S.A. (FR) | 1982-05-25 | — | — | US | disclosed |
| US-4006193-A | GERANIOL AND NEROL FROM LINALOOL, VANADATE CATALYST | KURARAY CO., LTD. (JA) | 1977-02-01 | — | — | US | disclosed |