⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24697554 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7461812 | 0.96 | — | — | |
| SCHEMBL413517 | 0.71 | — | — | |
| SCHEMBL185083 | 0.71 | — | — | |
| SCHEMBL15372069 | 0.71 | — | — | |
| SCHEMBL8673238 | 0.67 | — | — | |
| SCHEMBL21737299 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL21245480 | 0.64 | TSHR (0.36) | — | |
| SCHEMBL6023515 | 0.64 | POLB (0.36) | — | |
| SCHEMBL6023517 | 0.64 | POLB (0.36) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8182902-B2 | Labeled in-mold shaped article, and in-mold label | YUPO CORPORATION (JP) | 2012-05-22 | — | — | US | claimed |
| CN-104203961-B | Boron-based 4-hydroxytamoxifen and endoxifen prodrugs for treating breast cancer | 泽维尔大学 | 2017-05-17 | — | — | CN | disclosed |
| CN-106176709-A | Treatment medicine for tuberculosis compositions and preparation method thereof | 顺天乡大学校产学协力团 | 2016-12-07 | — | — | CN | disclosed |
| US-8182902-B2 | Labeled in-mold shaped article, and in-mold label | YUPO CORPORATION (JP) | 2012-05-22 | — | — | US | disclosed |
| US-20080118718-A1 | Labeled In-Mold Shaped Article, and In-Mold Label | YUPO CORPORATION (JP) | 2008-05-22 | — | — | US | disclosed |
| US-20070136954-A1 | Fabric care product containing a cellulose ether comprising amine groups | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 2007-06-21 | — | — | US | disclosed |
| EP-0767170-B1 | NOVEL 4,6-DIARYLPYRIMIDINE DERIVATIVES AND SALTS THEREOF | TAIHO PHARMACEUTICAL CO LTD (JP) | 2002-10-23 | — | — | EP | disclosed |
| EP-0804408-B1 | NOVEL 4-SUBSTITUTED 2,6-DI-TERT-BUTYLPHENOL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND PREPARATION METHOD THEREFOR | FILECO SA (FR) | 2001-09-05 | — | — | EP | disclosed |
| US-5834230-A | Viscosity Probe | MCGILL UNIVERSITY (CA) | 1998-11-10 | — | — | US | disclosed |
| US-5786355-A | COMPOUNDS FOR TREATMENT OF CANCER, RHEUMATISM, DIABETIC RETINOPATHY OR PSORIASIS | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 1998-07-28 | — | — | US | disclosed |
| EP-0767170-A1 | NOVEL 4,6-DIARYLPYRIMIDINE DERIVATIVES AND SALTS THEREOF | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 1997-04-09 | — | — | EP | disclosed |