Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL6757877 | 0.95 | CYP2A6 (0.44) | CYP2A6ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL29159006 | 0.93 | CYP2A6 (0.46) | CYP2A6ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL3795851 | 0.91 | CYP2A6 (0.44) | CYP2A6ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL30607044 | 0.85 | ESR2 (0.38) | CYP2A6ESR2GABRG2GABRB3GABRA5 | |
| SCHEMBL29051242 | 0.85 | ESR2 (0.38) | CYP2A6ESR2GABRG2GABRB3GABRA5 | |
| SCHEMBL6517747 | 0.84 | ESR2 (0.42) | CYP2A6ESR2FFAR1CYP1A2CYP2C9 | |
| SCHEMBL7932656 | 0.84 | MEN1 (0.33) | CYP2A6ALDH1A1MAPK1ESR2CYP1A2 | |
| SCHEMBL651587 | 0.82 | ALDH1A1 (0.44) | CYP2A6ALDH1A1HPGDMAPK1ESR2 | |
| SCHEMBL7932862 | 0.82 | ESR2 (0.41) | ALDH1A1HPGDMAPK1ESR2GRM5 | |
| SCHEMBL6512088 | 0.82 | ESR2 (0.41) | CYP2A6ESR2 |
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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114702516-A | Red fluorescent material based on BODIPY, preparation method and application thereof | 东南大学 | 2022-07-05 | — | — | CN | claimed |
| WO-2025106722-A1 | INHIBITORS OF STK33, RET, CLK, AND/OR RELATED KINASES AND METHODS USING SAME | BAYLOR COLLEGE OF MEDICINE (US) | 2025-05-22 | — | — | WO | disclosed |
| CN-118027090-A | Method for generating silanol by oxidizing silane | 吉林大学 | 2024-05-14 | — | — | CN | disclosed |
| CN-116444547-B | Naphthalene boron-nitrogen compound and application thereof | 浙江八亿时空先进材料有限公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-116891567-A | Preparation method and application of alpha-diimine palladium functionalized conjugated organic porous material | 泰山学院 | 2023-10-17 | — | — | CN | disclosed |
| CN-116444336-A | Fused ring compound and application thereof | 浙江八亿时空先进材料有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-116444547-A | Naphthalene boron-nitrogen compound and application thereof | 浙江八亿时空先进材料有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-116410475-A | Zirconium-based metal-organic framework material, preparation method and application thereof, adsorption separation device and method | 中国石油天然气股份有限公司 | 2023-07-11 | — | — | CN | disclosed |
| CN-114702516-A | Red fluorescent material based on BODIPY, preparation method and application thereof | 东南大学 | 2022-07-05 | — | — | CN | disclosed |
| CN-110563531-B | Synthetic method of 1, 2-disubstituted olefin compound | 浙江工业大学 | 2022-06-21 | — | — | CN | disclosed |
| WO-1998016503-A2 | THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 1998-04-23 | — | — | WO | disclosed |
| US-5276021-A | Anticholesterol or antilipemic agents | E. R. SQUIBB & SONS, INC. (US) | 1994-01-04 | — | — | US | disclosed |
| US-5091378-A | Anticholesterol agents | E. R. SQUIBB & SONS, INC. (US) | 1992-02-25 | — | — | US | disclosed |
| US-4536515-A | Substituted phenylalkenoic acids and esters | MERCK FROSST CANADA, INC. (CA) | 1985-08-20 | — | — | US | disclosed |
| US-4453005-A | Process for preparing substituted phenylalkenoic acids | MERCK FROSST CANADA, INC. (CA) | 1984-06-05 | — | — | US | disclosed |
| US-4301313-A | ANTIINFLAMMATORY AGENTS, ANTIPYRETICS, ANALGESICS | ELI-LILLY AND COMPANY (US) | 1981-11-17 | — | — | US | disclosed |
| US-4221895-A | POLYESTER, POLYSULFONATE, OR POLYSULFINATE | THE DOW CHEMICAL COMPANY (US) | 1980-09-09 | — | — | US | disclosed |
| US-4073936-A | Hypolipidemic allene carboxylic esters | SANDOZ, INC. (US) | 1978-02-14 | — | — | US | disclosed |
| US-4011339-A | ANTIINFLAMMATORY AGENTS | SANDOZ, INC. (US) | 1977-03-08 | — | — | US | disclosed |
| US-3979468-A | ANTIINFLAMMATORY AGENTS | ALLEN & HANBURYS LIMITED (EN) | 1976-09-07 | — | — | US | disclosed |