⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30157278 | 0.82 | WNT3A (0.31) | — | |
| SCHEMBL16418564 | 0.79 | — | — | |
| SCHEMBL24575351 | 0.71 | — | — | |
| SCHEMBL15687782 | 0.68 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL903629 | 0.67 | ALOX5 (0.31) | — | |
| SCHEMBL25324571 | 0.67 | NOS3 (0.31) | — | |
| SCHEMBL31401169 | 0.67 | ALOX5 (0.31) | — | |
| SCHEMBL11581910 | 0.61 | PRKCG (0.39) | — | |
| SCHEMBL29307458 | 0.61 | — | — | |
| SCHEMBL24521429 | 0.60 | KDM4E (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9975910-B2 | Hetero-fused cyclic compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-05-22 | — | — | US | claimed |
| US-20160168176-A1 | HETERO-FUSED CYCLIC COMPOUND | Eisai R&D Management Co., Lt.d (JP) | 2016-06-16 | — | — | US | claimed |
| US-9975910-B2 | Hetero-fused cyclic compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-05-22 | — | — | US | disclosed |
| US-9975910-B2 | Hetero-fused cyclic compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-05-22 | — | — | US | disclosed |
| US-9975910-B2 | Hetero-fused cyclic compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-05-22 | — | — | US | disclosed |
| US-20160168176-A1 | HETERO-FUSED CYCLIC COMPOUND | Eisai R&D Management Co., Lt.d (JP) | 2016-06-16 | — | — | US | disclosed |
| US-20160168176-A1 | HETERO-FUSED CYCLIC COMPOUND | Eisai R&D Management Co., Lt.d (JP) | 2016-06-16 | — | — | US | disclosed |
| US-20160168176-A1 | HETERO-FUSED CYCLIC COMPOUND | Eisai R&D Management Co., Lt.d (JP) | 2016-06-16 | — | — | US | disclosed |
| EP-3026054-A1 | HETERO-CONDENSED RING COMPOUND | Eisai R&D Management Co., Ltd. (JP) | 2016-06-01 | — | — | EP | disclosed |
| WO-2015012210-A1 | HETERO-CONDENSED RING COMPOUND | エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) | 2015-01-29 | — | — | WO | disclosed |