⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL48228 | 0.70 | DPYD (0.65) | — | |
| SCHEMBL10696940 | 0.70 | DPYD (0.65) | — | |
| SCHEMBL2092928 | 0.67 | ALDH1A1 (0.46) | — | |
| Water SCHEMBL3285066 | 0.65 | ALDH1A1 (0.45) | — | |
| Thymine SCHEMBL8304423 | 0.62 | ATAD2 (0.83) | — | |
| SCHEMBL5801644 | 0.61 | ALDH1A1 (0.64) | — | |
| SCHEMBL2888210 | 0.61 | — | — | |
| SCHEMBL18476607 | 0.61 | — | — | |
| SCHEMBL29822911 | 0.61 | DPYD (0.44) | — | |
| SCHEMBL10278083 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| US-7777015-B2 | Cytochrome P-450 gene cluster from Rhodococcus ruber and uses thereof in ether fuel cleavage | INSTITUT FRANCAIS DU PETROLE (FR) | 2010-08-17 | — | — | US | disclosed |
| US-20100197752-A1 | UROCANIC ACID DERIVATIVES USEFUL FOR THE TREATMENT OF IMMUNE-RELATED AND INFLAMMATORY DISEASES | VALLETTA HEALTH IP EE B.V. (NL) | 2010-08-05 | — | — | US | disclosed |
| EP-1270722-B1 | Cytochrome p-450 gene cluster from rhodococcus ruber and uses thereof in ether fuel cleavage | INST FRANCAIS DU PETROLE (FR) | 2007-01-10 | — | — | EP | disclosed |
| US-20040214787-A1 | Cytochrome P-450 gene cluster from rhodococcus ruber and uses thereof in ether fuel cleavage | INSTITUT PASTEUR (FR) | 2004-10-28 | — | — | US | disclosed |
| WO-2003000884-A2 | CYTOCHROME P-450 GENE CLUSTER FROM RHODOCOCCUS RUBER AND USES THEREOF IN ETHER FUEL CLEAVAGE | INSTITUT PASTEUR (FR) | 2003-01-03 | — | — | WO | disclosed |
| EP-1270722-A1 | Cytochrome p-450 gene cluster from rhodococcus ruber and uses thereof in ether fuel cleavage | INSTITUT PASTEUR (FR) | 2003-01-02 | — | — | EP | disclosed |
| EP-0022964-B1 | NIKKOMYCINES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS A PESTICIDAL AGENT | BAYER AG (DE) | 1983-02-09 | — | — | EP | disclosed |
| US-4345936-A | Imidazoles, compositions and herbicidal method | ELI LILLY AND COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| US-4345936-A | Imidazoles, compositions and herbicidal method | ELI LILLY AND COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| US-4315922-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1982-02-16 | — | — | US | disclosed |
| EP-0013766-B1 | ANTIBIOTICS, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS PLANT PROTECTING AGENTS | BAYER AG (DE) | 1981-11-11 | — | — | EP | disclosed |
| EP-0022964-A2 | Nikkomycines, process for their preparation, and their use as a pesticidal agent | BAYER AG (DE) | 1981-01-28 | — | — | EP | disclosed |
| EP-0013766-A1 | Antibiotics, process for their preparation, and their use as plant protecting agents | BAYER AG (DE) | 1980-08-06 | — | — | EP | disclosed |