⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14108581 | 0.87 | — | — | |
| SCHEMBL3236585 | 0.78 | ALDH1A1 (0.42) | — | |
| SCHEMBL178955 | 0.77 | THRB (0.40) | — | |
| SCHEMBL9051267 | 0.76 | — | — | |
| SCHEMBL333711 | 0.74 | — | — | |
| SCHEMBL8943888 | 0.74 | — | — | |
| SCHEMBL647958 | 0.74 | — | — | |
| SCHEMBL11117617 | 0.74 | — | — | |
| SCHEMBL8210537 | 0.72 | LDHA (0.40) | — | |
| SCHEMBL3297298 | 0.72 | MGAM (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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0318845-B1 | METHOD FOR THE PREPARATION OF SUBSTITUTED PYRIDINES | BASF Aktiengesellschaft (DE) | 1992-09-16 | — | — | EP | claimed |
| EP-0318845-A2 | Method for the preparation of substituted pyridines | BASF Aktiengesellschaft (DE) | 1989-06-07 | — | — | EP | claimed |
| EP-3416729-B1 | PRO-FRAGRANCE COMPOSITION | AQDOT LTD (GB) | 2023-09-20 | — | — | EP | disclosed |
| WO-2023084449-A1 | DIAMINOCYCLOPENTYLPYRIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER | NOVARTIS AG (CH) | 2023-05-19 | — | — | WO | disclosed |
| US-10695277-B2 | Pro-fragrance composition | AQDOT LIMITED (GB) | 2020-06-30 | — | — | US | disclosed |
| US-20190046426-A1 | PRO-FRAGRANCE COMPOSITION | AQDOT LIMITED (GB) | 2019-02-14 | — | — | US | disclosed |
| EP-3416729-A1 | PRO-FRAGRANCE COMPOSITION | Aqdot Limited (GB) | 2018-12-26 | — | — | EP | disclosed |
| WO-2017141030-A1 | PRO-FRAGRANCE COMPOSITION | AQDOT LIMITED (GB) | 2017-08-24 | — | — | WO | disclosed |
| EP-1360990-B1 | Double-metal cyanide catalysts for preparing polyether polyols | BAYER ANTWERPEN NV (BE) | 2005-10-12 | — | — | EP | disclosed |
| US-6797665-B2 | COMPLEX POLYMERIZATION CATALYST FOR POLYETHERS | BAYER ANTWERPEN (BE) | 2004-09-28 | — | — | US | disclosed |
| US-20030211935-A1 | Double-metal cyanide catalysts for preparing polyether polyols | BAYER ANTWERPEN, N.V. (BE) | 2003-11-13 | — | — | US | disclosed |
| EP-0427335-A1 | An aqueous process for the preparation of 5-methyl-N-(aryl)-1,2,4-triazolo (1,5-a)pyrimidine-2-sulfonamides | DOWELANCO (US) | 1991-05-15 | — | — | EP | disclosed |
| US-4988812-A | Aqueous process for the preparation of 5-methyl-n-(aryl)-1,2,4-triazolo(1,5-A)pyrimidine-2-sulfonamides | DOW ELANCO (US) | 1991-01-29 | — | — | US | disclosed |
| US-4927827-A | Pyridinylpyrimidine derivatives, method for production thereof and a fungicide containing them as the active ingredient | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1990-05-22 | — | — | US | disclosed |
| US-4866175-A | REACTING BENZOFUROXAN WITH MALONIC ESTER, CYANO(ESTER OR AMIDE), KETO(ESTER OR AMIDE), DIKETONE, MALONONITRILE, OR NITRO COMPOUND | RESEARCH CORPORATION (US) | 1989-09-12 | — | — | US | disclosed |
| US-4343942-A | BACTERICIDES | RESEARCH CORPORATION (US) | 1982-08-10 | — | — | US | disclosed |
| US-4147791-A | 1-Substituted-1,2,4-triazole fungicidal compositions and methods for combatting fungi that infect or attack plants | BAYER AKTIENGESELLSCHAFT (DE) | 1979-04-03 | — | — | US | disclosed |
| US-4107159-A | Acetal hydrazones of 2-hydrazino-3H-1,4-benzodiazepine | THE UPJOHN COMPANY (US) | 1978-08-15 | — | — | US | disclosed |
| US-4086230-A | 1,5-Dihydro-7-aryl-as-triazine[4,3,-α][1,4]benzodiazepin-1-ols | THE UPJOHN COMPANY (US) | 1978-04-25 | — | — | US | disclosed |
| US-4048318-A | 1-Substituted-1,2,4-triazole fungicides | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | disclosed |