⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1471843 | 1.00 | — | — | |
| SCHEMBL8764246 | 1.00 | UGT2B7 (0.32) | — | |
| SCHEMBL1464686 | 0.88 | — | — | |
| SCHEMBL7802318 | 0.88 | UGT2B7 (0.31) | — | |
| SCHEMBL10524293 | 0.86 | TP53 (0.41) | — | |
| SCHEMBL2511775 | 0.86 | TP53 (0.41) | — | |
| SCHEMBL15203259 | 0.83 | SHBG (0.35) | — | |
| SCHEMBL8718770 | 0.82 | ALDH1A1 (0.38) | — | |
| SCHEMBL6112257 | 0.82 | — | — | |
| SCHEMBL7586183 | 0.82 | CPN1 (0.35) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050119241-A1 | Preparation of 24 alkyl analogs of cholecalciferol and non-racemic compounds | INSTYTUT FARMACEUTYCZNY (PL) | 2005-06-02 | — | — | US | claimed |
| EP-1497264-A2 | PREPARATION OF 24-ALKYL ANALOGS OF CHOLECALCIFEROL AND NON-RACEMIC COMPOUNDS | INSTYTUT FARMACEUTYCZNY (PL) | 2005-01-19 | — | — | EP | claimed |
| WO-2003087048-A2 | PREPARATION OF 24 ALKYL ANALOGS OF CHOLECALCIFEROL AND NON-RACEMIC COMPOUNDS | INSTYTUT FARMACEUTYCZNY (PL) | 2003-10-23 | — | — | WO | claimed |
| WO-2014168262-A1 | KINASE INHIBITORS CONTAINING CYCLOPROPANE SKELETON | D.D.P. CORPORATION (JP) | 2014-10-16 | — | — | WO | disclosed |
| US-8450319-B2 | Pyrrolopyridazinone compound | UBE INDUSTRIES, LTD. (JP) | 2013-05-28 | — | — | US | disclosed |
| CN-102911041-A | Photostable cis 2, 3-cyclopropanated abscisic acid analogue and preparation method thereof | UNIV CHINA AGRICULTURAL | 2013-02-06 | — | — | CN | disclosed |
| EP-1982986-B1 | PYRROLOPYRIDAZINONE COMPOUND AS PDE4 INHIBITOR | UBE INDUSTRIES (JP) | 2012-03-07 | — | — | EP | disclosed |
| US-20110268698-A1 | METHODS FOR TREATING HEPATITIS C | PTC THERAPEUTICS, INC. (US) | 2011-11-03 | — | — | US | disclosed |
| US-7915241-B2 | Reacting a sulfone intermediate, possessing a (5E) or (5Z) configuration with an aldehyde having an (R) or an (S) configuration in the presence of a strong base, in an aprotic solvent; synthetic analog of vitamin D3-calcipotriol, biologically active compound used in medical treatment | INSTYTUT FARMACEUTYCZNY (PL) | 2011-03-29 | — | — | US | disclosed |
| US-20090036453-A1 | Pyrrolopyridazinone Compound | UBE INDUSTRIES, LTD. (JP) | 2009-02-05 | — | — | US | disclosed |
| EP-1982986-A1 | PYRROLOPYRIDAZINONE COMPOUND | Ube Industries, Ltd. (JP) | 2008-10-22 | — | — | EP | disclosed |
| US-20070088007-A1 | Method for preparing analogue of vitamin D | FORMOSA LABORATORIES, INC. (TW) | 2007-04-19 | — | — | US | disclosed |
| US-20070088007-A1 | Method for preparing analogue of vitamin D | FORMOSA LABORATORIES, INC. (TW) | 2007-04-19 | — | — | US | disclosed |
| US-20050119241-A1 | Preparation of 24 alkyl analogs of cholecalciferol and non-racemic compounds | INSTYTUT FARMACEUTYCZNY (PL) | 2005-06-02 | — | — | US | disclosed |
| EP-1497264-A2 | PREPARATION OF 24-ALKYL ANALOGS OF CHOLECALCIFEROL AND NON-RACEMIC COMPOUNDS | INSTYTUT FARMACEUTYCZNY (PL) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003087048-A2 | PREPARATION OF 24 ALKYL ANALOGS OF CHOLECALCIFEROL AND NON-RACEMIC COMPOUNDS | INSTYTUT FARMACEUTYCZNY (PL) | 2003-10-23 | — | — | WO | disclosed |
| US-4500541-A | Pharmacologically active cyclopropane derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-02-19 | — | — | US | disclosed |
| EP-0039771-B1 | CYCLOPROPANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PRODUCTION | MERCK PATENT GmbH (DE) | 1983-10-19 | — | — | EP | disclosed |
| EP-0039771-A1 | Cyclopropane derivatives, pharmaceutical compositions containing them and processes for their production | MERCK PATENT GmbH (DE) | 1981-11-18 | — | — | EP | disclosed |