⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29956040 | 1.00 | — | — | |
| SCHEMBL13494713 | 1.00 | — | — | |
| SCHEMBL13351117 | 0.83 | FOLH1 (0.38) | — | |
| SCHEMBL14819043 | 0.82 | CHRM1 (0.44) | — | |
| SCHEMBL17706682 | 0.82 | CHRM1 (0.44) | — | |
| SCHEMBL16623914 | 0.81 | — | — | |
| SCHEMBL12437233 | 0.81 | — | — | |
| SCHEMBL20239054 | 0.81 | — | — | |
| SCHEMBL1569122 | 0.79 | — | — | |
| SCHEMBL10443312 | 0.79 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210069288-A1 | PCSK9 ANTAGONIST COMPOUNDS | MERCK SHARP & DOHME LLC | 2021-03-11 | — | — | US | disclosed |
| WO-2016149501-A2 | MODIFIED THERAPEUTIC AGENTS AND COMPOSITIONS THEREOF | THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2016-09-22 | — | — | WO | disclosed |
| US-20150099800-A1 | NOVEL LIPASE INHIBITORS, REPORTER SUBSTRATES AND USES THEREOF | NIH - DEITR | 2015-04-09 | — | — | US | disclosed |
| US-8003686-B2 | Aryl derivatives of curcumin, demethoxycurcumin, bisdemethoxycurcumin or curcuminisoxazolide and their use as animal feed additives | DSM IP ASSETS B.V. (NL) | 2011-08-23 | — | — | US | disclosed |
| WO-2010144675-A1 | POLYMORPHS OF BENDAMUSTINE HCL AND PROCESSES FOR PREPARATION THEREOF | PLUS CHEMICALS SA (CH) | 2010-12-16 | — | — | WO | disclosed |
| US-20100010232-A1 | Aryl derivatives of curcumin, demethoxycurcumin, bisdemethoxycurcumin or curcuminisoxazolide and their use as animal feed additives | DSM IP ASSETS B.V. (NL) | 2010-01-14 | — | — | US | disclosed |
| EP-1876908-A1 | ARYL DERIVATIVES OF CURCUMIN, DEMETHOXYCURCUMIN, BISDEMETHOXYCURCUMIN OR CURCUMINISOXAZOLIDE AND THEIR USE AS ANIMAL FEED ADDITIVES | DSMIP Assets B.V. (NL) | 2008-01-16 | — | — | EP | disclosed |
| WO-2006117077-A1 | ARYL DERIVATIVES OF CURCUMIN, DEMETHOXYCURCUMIN, BISDEMETHOXYCURCUMIN OR CURCUMINISOXAZOLIDE AND THEIR USE AS ANIMAL FEED ADDITIVES | DSM IP ASSETS B.V. (NL) | 2006-11-09 | — | — | WO | disclosed |
| EP-0647632-A1 | NOVEL BENZODIAZEPINE DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1995-04-12 | — | — | EP | disclosed |