⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1444158 | 0.90 | LMNA (0.52) | — | |
| SCHEMBL41297 | 0.89 | CHKA (0.52) | — | |
| SCHEMBL114702 | 0.89 | CHKA (0.46) | — | |
| SCHEMBL161122 | 0.88 | ADRA2C (0.57) | — | |
| SCHEMBL27853947 | 0.88 | F2 (0.38) | — | |
| SCHEMBL146936 | 0.87 | ALDH1A1 (0.52) | — | |
| SCHEMBL693166 | 0.87 | ALDH1A1 (0.52) | — | |
| SCHEMBL1900341 | 0.87 | ALDH1A1 (0.52) | — | |
| SCHEMBL11376502 | 0.86 | MAPT (0.61) | — | |
| SCHEMBL4033039 | 0.86 | CHKA (0.61) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104364234-A | AMIDOPHENOXYPROPANOLAMINES | UNIV WIEN MED | 2015-02-18 | — | — | CN | claimed |
| CN-111777596-A | Indolone compounds and use thereof | 英克特诺治疗公司 | 2020-10-16 | — | — | CN | disclosed |
| CN-107108580-B | Indolone compounds and use thereof | 英克特诺治疗公司 | 2020-06-30 | — | — | CN | disclosed |
| CN-108186564-B | Tumor microenvironment responsive gene nano micelle and preparation method and application thereof | 上海市肿瘤研究所 | 2020-06-02 | — | — | CN | disclosed |
| CN-108186564-B | Tumor microenvironment responsive gene nano micelle and preparation method and application thereof | 上海市肿瘤研究所 | 2020-06-02 | — | — | CN | disclosed |
| CN-110393805-A | Polymer support of nanometer enzyme modification and preparation method thereof, anti-tumor nano particle | UNIV WENZHOU MEDICAL | 2019-11-01 | — | — | CN | disclosed |
| CN-110343255-A | Polymer support and preparation method thereof, anti-tumor nano particle | 温州医科大学 | 2019-10-18 | — | — | CN | disclosed |
| CN-109415366-A | Novel [1,2,3] triazol [4,5-d] pyrimidine derivatives | 豪夫迈·罗氏有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-104364234-A | AMIDOPHENOXYPROPANOLAMINES | UNIV WIEN MED | 2015-02-18 | — | — | CN | disclosed |
| WO-2006017761-A2 | EPOTHILONE ANALOGUES AS THERAPEUTIC AGENTS | EMORY UNIVERSITY (US) | 2006-02-16 | — | — | WO | disclosed |