⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1832217 | 0.76 | — | — | |
| SCHEMBL24922320 | 0.75 | — | — | |
| SCHEMBL19691092 | 0.73 | SMYD3 (0.43) | — | |
| SCHEMBL23113893 | 0.71 | — | — | |
| SCHEMBL23266336 | 0.71 | CES1 (0.37) | — | |
| SCHEMBL14152761 | 0.69 | CES1 (0.36) | — | |
| SCHEMBL2363536 | 0.69 | P2RX7 (0.60) | — | |
| SCHEMBL17580070 | 0.67 | PLK1 (0.37) | — | |
| SCHEMBL9948788 | 0.67 | P2RX7 (0.37) | — | |
| SCHEMBL2393111 | 0.66 | HDAC2 (0.39) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210323960-A1 | FUSED TRI-CYCLIC COMPOUND AS PDE3/PDE4 DUAL INHIBITOR | CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) | 2021-10-21 | — | — | US | disclosed |
| EP-3822272-A1 | FUSED TRI-CYCLIC COMPOUND AS PDE3/PDE4 DUAL INHIBITOR | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2021-05-19 | — | — | EP | disclosed |
| EP-0942908-A1 | THIENYLSULFONYLAMINO(THIO)CARBONYL COMPOUNDS | BAYER AG (DE) | 1999-09-22 | — | — | EP | disclosed |
| WO-1998024787-A1 | THIENYLSULFONYLAMINO(THIO)CARBONYL COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-06-11 | — | — | WO | disclosed |