Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 3/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.39 |
| ▸ | BCR | P11274 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP4B1 | P13584 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL491166 | 0.87 | ALDH1A1 (0.48) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 | |
| SCHEMBL8629428 | 0.86 | ESR1 (0.42) | ALDH1A1CYP1A1CYP1B1CYP3A4ABL1 | |
| SCHEMBL3932720 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 | |
| SCHEMBL744029 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 | |
| SCHEMBL744349 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 | |
| SCHEMBL491242 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 | |
| SCHEMBL9444304 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| SCHEMBL28421814 | 0.82 | ALDH1A1 (0.39) | ALDH1A1CYP1A1CYP1B1CYP3A4ABL1 | |
| SCHEMBL1637765 | 0.81 | TUBB4A (0.37) | ALDH1A1ESR1PTGS2TUBB4ATUBB | |
| SCHEMBL29078261 | 0.79 | CA1 (0.41) | ALDH1A1CYP1A1CYP1B1CYP3A4CA1 |
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
Appears in 3861 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118344695-A | Hydroxyl-enriched cycloolefin copolymer long afterglow material and application thereof | 重庆理工大学 | 2024-07-16 | — | — | CN | claimed |
| CN-116178267-B | Chiral N-heterocyclic carbene nitrile oxide adduct organic catalyst and application thereof | 大连理工大学 | 2024-06-28 | — | — | CN | claimed |
| CN-118125959-A | Pyrrole derivative and preparation method and application thereof | 南京农业大学 | 2024-06-04 | — | — | CN | claimed |
| EP-4349813-A1 | QUATERNARY AMMONIUM SALT COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | Yichang Humanwell Pharmaceutical Co., Ltd. (CN) | 2024-04-10 | — | — | EP | claimed |
| WO-2024060641-A1 | CYCLOTRIARYLPHOSPHINE, METHOD FOR PREPARING SAME, AND USE THEREOF | 东莞市均成高新材料有限公司 | 2024-03-28 | — | — | WO | claimed |
| CN-114797989-B | Supported catalyst and preparation method and application thereof | 卫星化学股份有限公司 | 2024-02-23 | — | — | CN | claimed |
| CN-117279892-A | Quaternary amine salt compound and preparation method and application thereof | 宜昌人福药业有限责任公司 | 2023-12-22 | — | — | CN | claimed |
| CN-117164641-A | Nickel complex for synthesizing polyketone resin, preparation method and application | 大连理工大学 | 2023-12-05 | — | — | CN | claimed |
| WO-2023221952-A1 | CYCLIC QUATERNARY AMMONIUM SALT COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 宜昌人福药业有限责任公司 | 2023-11-23 | — | — | WO | claimed |
| US-11807620-B2 | Quinazolinone compounds and related compounds | Plexium, Inc. (US) | 2023-11-07 | — | — | US | claimed |
| US-4342869-A | Cephalosporin antibiotics | MERCK & CO., INC. (US) | 1982-08-03 | — | — | US | claimed |
| US-4342757-A | Cephalosporin antibiotic compositions | MERCK & CO., INC. (US) | 1982-08-03 | — | — | US | claimed |
| US-4338438-A | Cephalosporin antibiotics | MERCK & CO., INC. (US) | 1982-07-06 | — | — | US | claimed |
| US-4338437-A | Cephalosporin antibiotics | MERCK & CO., INC. (US) | 1982-07-06 | — | — | US | claimed |
| US-4316037-A | N-Benzyl and N-substituted benzyl tetrazole-5-carboxylic acids and the preparation thereof | AMERICAN HOME PRODUCTS CORPORATION (US) | 1982-02-16 | — | — | US | claimed |
| US-4310459-A | Process for producing carbamoyl substituted penams and carbamoyl substituted cephams from penicillin sulfoxide esters | BRISTOL-MYERS COMPANY (US) | 1982-01-12 | — | — | US | claimed |
| US-4298741-A | DETHIAPENICILLIN ANTIBIOTICS | MERCK & CO., INC. (US) | 1981-11-03 | — | — | US | claimed |
| US-4297488-A | 7-α-Methoxy cephalosporins | MERCK & CO., INC. (US) | 1981-10-27 | — | — | US | claimed |
| US-4258040-A | Cephalosporin compounds | MERCK & CO., INC. (US) | 1981-03-24 | — | — | US | claimed |
| US-4060687-A | Cephalosporins having a 3-α substituted alkyl grouping | MERCK & CO., INC. (US) | 1977-11-29 | — | — | US | claimed |