⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9216830 | 1.00 | — | — | |
| SCHEMBL14890874 | 1.00 | — | — | |
| SCHEMBL10087477 | 1.00 | — | — | |
| SCHEMBL3426947 | 1.00 | — | — | |
| SCHEMBL22030300 | 1.00 | — | — | |
| SCHEMBL20530474 | 1.00 | — | — | |
| SCHEMBL20530494 | 1.00 | — | — | |
| SCHEMBL20852424 | 1.00 | — | — | |
| SCHEMBL20530459 | 1.00 | — | — | |
| SCHEMBL15074247 | 0.85 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210369873-A1 | COMPOSITIONS AND METHODS FOR DETECTION OF TRAUMATIC BRAIN INJURY | Amydis, Inc. | 2021-12-02 | — | — | US | disclosed |
| US-20190177713-A1 | METHODS AND MICROORGANISMS FOR PRODUCING FLAVORS AND FRAGRANCE CHEMICALS | ARDRA INC. (CA) | 2019-06-13 | — | — | US | disclosed |
| WO-2017168161-A1 | MODIFIED ENZYME | ZUVASYNTHA LIMITED (GB) | 2017-10-05 | — | — | WO | disclosed |
| EP-1969131-A1 | PROCESS FOR THE PREPARATION OF DELTA LACTONES | Isobionics B.V. (NL) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007068498-A1 | PROCESS FOR THE PREPARATION OF DELTA LACTONES | ISOBIONICS B.V. (NL) | 2007-06-21 | — | — | WO | disclosed |
| US-5795749-A | Use of 2-deoxyribose-5-phosphate aldolase to prepare 2-deoxyfucose, analogues and derivatives | THE SCRIPPS RESEARCH INSTITUTION (US) | 1998-08-18 | — | — | US | disclosed |
| WO-1996031615-A1 | USE OF 2-DEOXYRIBOSE-5-PHOSPHATE ALDOLASE TO PREPARE 2-DEOXYFUCOSE, ANALOGUES AND DERIVATIVES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1996-10-10 | — | — | WO | disclosed |