⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL5467078 | 0.83 | ALDH1A1 (0.41) | — | |
| SCHEMBL2460939 | 0.80 | — | — | |
| SCHEMBL8313187 | 0.79 | — | — | |
| SCHEMBL6776556 | 0.77 | ALDH1A1 (0.44) | — | |
| SCHEMBL17460080 | 0.76 | — | — | |
| SCHEMBL6379592 | 0.75 | — | — | |
| SCHEMBL1116709 | 0.75 | CPA1 (0.55) | — | |
| SCHEMBL6379596 | 0.75 | — | — | |
| SCHEMBL29817855 | 0.75 | CPA1 (0.37) | — | |
| SCHEMBL6261483 | 0.75 | NFKB1 (0.48) | — |
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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7271300-B1 | Picric acid explosive compound and environmentally friendly methods for making the same | UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2007-09-18 | — | — | US | claimed |
| US-20250146213-A1 | METHODS OF USING A PHENOLIC FATTY ACID COMPOUND ON A SYNTHETIC FABRIC MATERIAL | SI GROUP, INC. | 2025-05-08 | — | — | US | disclosed |
| CN-119613408-A | Bicyclic ketone compounds and methods of use thereof | 豪夫迈·罗氏有限公司 | 2025-03-14 | — | — | CN | disclosed |
| US-12221745-B2 | Methods of using a phenolic fatty acid compound on a synthetic fabric material | SI GROUP, INC. (US) | 2025-02-11 | — | — | US | disclosed |
| CN-110914271-B | Bicyclic ketone compounds and methods of use thereof | 豪夫迈·罗氏有限公司 | 2024-12-10 | — | — | CN | disclosed |
| US-20240300974-A1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2024-09-12 | — | — | US | disclosed |
| EP-4397309-A2 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | F. Hoffmann-La Roche AG (CH) | 2024-07-10 | — | — | EP | disclosed |
| EP-3652178-B1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | HOFFMANN LA ROCHE (CH) | 2024-01-24 | — | — | EP | disclosed |
| US-11834461-B2 | Bicyclic ketone compounds and methods of use thereof | GENENTECH, INC. (US) | 2023-12-05 | — | — | US | disclosed |
| US-11834461-B2 | Bicyclic ketone compounds and methods of use thereof | GENENTECH, INC. (US) | 2023-12-05 | — | — | US | disclosed |
| US-5883134-A | APPLYING 1-(ALKYLSULFINYL- OR ALKYLSULFONYL)-2-NITROETHENE DERIVATIVE AS BACTERICIDE, FUNGICIDE, AND/OR ALGICIDE | ROHM AND HAAS COMPANY (US) | 1999-03-16 | — | — | US | disclosed |
| CN-1160481-A | Broad-spectrum antimicrobially active compounds | ROHM & HAAS (US) | 1997-10-01 | — | — | CN | disclosed |
| EP-0765870-A2 | Broad-spectrum antimicrobially active compounds | ROHM AND HAAS COMPANY (US) | 1997-04-02 | — | — | EP | disclosed |
| EP-0759917-A1 | NOVEL SELECTIVE INHIBITORS OF VIRAL OR BACTERIAL NEURAMINIDASES | GILEAD SCIENCES, INC. (US) | 1997-03-05 | — | — | EP | disclosed |
| US-4496772-A | Preparation of nitroalcohols | THE BF GOODRICH COMPANY (US) | 1985-01-29 | — | — | US | disclosed |
| US-4478597-A | IMPREGNATION NATURAL FIBERS WITH TRIS(HYDROXYMETHYL)NITROMETHANE AND HEATING | ANGUS CHEMICAL COMPANY (US) | 1984-10-23 | — | — | US | disclosed |
| US-4238545-A | USING NITRO ALKANOLS AND/OR NITROALKANE; PERMANENT PRESS FABRICS | INTERNATIONAL MINERALS & CHEMICAL CORPORATION (US) | 1980-12-09 | — | — | US | disclosed |
| US-4219631-A | WITH A NITROALKANOL; TREATING TEXTILES AND NON-WOVEN CELLULOSIC PRODUCTS TO PROVIDE WRINKLE RESISTANCE, PERMANENT PRESS | INTERNATIONAL MINERALS & CHEMICAL CORP. (US) | 1980-08-26 | — | — | US | disclosed |
| US-4058541-A | Preparation of 2-alkanoyloxy-alkanoic | TEXACO INC. (US) | 1977-11-15 | — | — | US | disclosed |
| US-4058540-A | FROM A NITROALKYL NITRATE OR NITRO ALCOHOL AND ALKANOIC ACID, CALCIUM OCIDE OR CARBOXYLATE CATALYST | TEXACO INC. (US) | 1977-11-15 | — | — | US | disclosed |