Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 8/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | IAPP | P10997 | 2/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | TCF4 | P15884 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9717543 | 0.89 | HTT (0.53) | ALDH1A1HSD17B3HTTTHRBTHRA | |
| SCHEMBL10356111 | 0.86 | HTT (0.58) | ALDH1A1HSD17B3HTTTHRBTHRA | |
| SCHEMBL11603708 | 0.86 | HTT (0.58) | ALDH1A1HSD17B3HTTTHRBTHRA | |
| SCHEMBL10846560 | 0.85 | HSP90AB1 (0.53) | TSHRHPGDALDH1A1RECQLHTT | |
| SCHEMBL9717586 | 0.83 | MAPK1 (0.40) | TSHRHPGDALDH1A1ALOX15RECQL | |
| SCHEMBL9734150 | 0.81 | KMT2A (0.42) | TSHRHPGDALDH1A1HSD17B10HTT | |
| SCHEMBL10405139 | 0.80 | THRB (0.45) | TSHRHPGDALDH1A1ALOX15RECQL | |
| SCHEMBL11603324 | 0.77 | THRB (0.52) | TSHRALDH1A1RECQLHSD17B10HTT | |
| SCHEMBL22500456 | 0.77 | HTT (0.51) | TSHRHPGDALDH1A1ALOX15RECQL | |
| SCHEMBL63797 | 0.77 | ALDH1A1 (0.55) | TSHRHPGDALDH1A1ALOX15RECQL |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119390664-A | Crystal form of compound containing alpha, beta unsaturated ketone and preparation method thereof | 山东大学 | 2025-02-07 | — | — | CN | disclosed |
| EP-0947494-A1 | Derivatives of phenoxy acetic acid and phenoxymethyltetrazole having antitumor activity | F. HOFFMANN-LA ROCHE AG (CH) | 1999-10-06 | — | — | EP | disclosed |
| EP-0947511-A1 | Derivatives of phenoxy acetic acid and of phenoxymethyl tetrazole having antitumor activity | F. HOFFMANN-LA ROCHE AG (CH) | 1999-10-06 | — | — | EP | disclosed |
| EP-0240256-B1 | COMPOUNDS USEFUL IN TREATING SICKLE CELL ANEMIA | MERCK & CO. INC. (US) | 1992-04-29 | — | — | EP | disclosed |
| EP-0363688-A1 | Novel phosphoric acid derivatives and a method for determination of acid phosphatase activity using the same | NITTO BOSEKI CO., LTD. (JP) | 1990-04-18 | — | — | EP | disclosed |
| US-4731473-A | Compounds useful in treating sickle cell anemia | MERCK & CO., INC. (US) | 1988-03-15 | — | — | US | disclosed |
| US-4731381-A | Method of treating a person for sickle cell anemia | MERCK & CO., INC. (US) | 1988-03-15 | — | — | US | disclosed |
| US-4699926-A | Compounds useful in treating sickle cell anemia | MERCK & CO., INC. (US) | 1987-10-13 | — | — | US | disclosed |
| EP-0240256-A2 | Compounds useful in treating sickle cell anemia | MERCK & CO. INC. (US) | 1987-10-07 | — | — | EP | disclosed |
| US-4085219-A | DIURETICS, SALURETICS, URICOSURIC AGENTS | MERCK & CO., INC. (US) | 1978-04-18 | — | — | US | disclosed |
| US-4081554-A | DIURETICS, SALURETICS, URICOSURICS | MERCK & CO., INC. (US) | 1978-03-28 | — | — | US | disclosed |
| US-4070539-A | DIURETICS, SALURETICS | MERCK & CO., INC. (US) | 1978-01-24 | — | — | US | disclosed |
| US-3984465-A | DIURETIC, SALURETIC AND URICOSURIC | MERCK & CO., INC. (US) | 1976-10-05 | — | — | US | disclosed |
| US-3931239-A | DIURETIC, HYPOTENSIVE | MERCK & CO., INC. (US) | 1976-01-06 | — | — | US | disclosed |