⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28909388 | 0.98 | LMNA (0.42) | — | |
| SCHEMBL27790504 | 0.83 | TSHR (0.38) | — | |
| SCHEMBL29433283 | 0.82 | LMNA (0.45) | — | |
| SCHEMBL28236712 | 0.81 | CHRNB2 (0.32) | — | |
| SCHEMBL9729698 | 0.80 | — | — | |
| SCHEMBL207281 | 0.78 | — | — | |
| SCHEMBL16612904 | 0.78 | LMNA (0.42) | — | |
| SCHEMBL6231322 | 0.78 | — | — | |
| SCHEMBL9177236 | 0.76 | LMNA (0.45) | — | |
| SCHEMBL8750063 | 0.76 | LMNA (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111356680-B | Selective inhibitors of NLRP3 inflammasome | 诺瑟拉有限公司 | 2023-11-28 | — | — | CN | disclosed |
| CN-111356680-A | Selective inhibitors of NLRP3inflammasome | 诺瑟拉有限公司 | 2020-06-30 | — | — | CN | disclosed |
| CN-105175277-B | A kind of inhibitor of 3 GAPD and its preparation method and application | 中山大学肿瘤防治中心 | 2018-04-03 | — | — | CN | disclosed |
| CN-105175277-A | Inhibitor of glyceraldehyde-3-phosphate dehydrogenase, preparation method and application thereof | UNIV SUN YAT SEN CANCER CT | 2015-12-23 | — | — | CN | disclosed |
| US-20080076760-A1 | 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION | WAKAMOTO PHARMACEUTICAL CO., LTD (JP) | 2008-03-27 | — | — | US | disclosed |
| EP-1820799-A1 | 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION | Wakamoto Pharmaceutical Co., Ltd. (JP) | 2007-08-22 | — | — | EP | disclosed |
| EP-1200405-A1 | BENZENAMINE DERIVATIVES AS ANTI-COAGULANTS | BERLEX LABORATORIES, INC. (US) | 2002-05-02 | — | — | EP | disclosed |
| US-6350761-B1 | INHIBITORS OF THE ENZYME, FACTOR XA; | BERLEX LABORATORIES, INC. | 2002-02-26 | — | — | US | disclosed |
| WO-2001009093-A1 | BENZENAMINE DERIVATIVES AS ANTI-COAGULANTS | BERLEX LABORATORIES, INC. (US) | 2001-02-08 | — | — | WO | disclosed |