⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17835258 | 1.00 | — | — | |
| SCHEMBL14474737 | 1.00 | — | — | |
| SCHEMBL2163319 | 1.00 | — | — | |
| SCHEMBL17835257 | 1.00 | — | — | |
| SCHEMBL8736366 | 1.00 | — | — | |
| SCHEMBL13392845 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL27683920 | 0.98 | CNR2 (0.35) | — | |
| SCHEMBL4840204 | 0.95 | TSHR (0.43) | — | |
| SCHEMBL4840420 | 0.93 | TSHR (0.41) | — | |
| SCHEMBL16900558 | 0.92 | TSHR (0.38) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885318-A1 | FLASH SPINNING PROCESS AND PRODUCTS | E.I. DU PONT DE NEMOURS & COMPANY INCORPORATED (US) | 1998-12-23 | — | — | EP | claimed |
| WO-1997033021-A1 | FLASH SPINNING PROCESS AND PRODUCTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-09-12 | — | — | WO | claimed |
| US-11174245-B2 | Benzimidazole compounds and derivatives as EGFR inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2021-11-16 | — | — | US | disclosed |
| US-20200377476-A1 | NEW BENZIMIDAZOLE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2020-12-03 | — | — | US | disclosed |
| US-10570145-B2 | TYK2 inhibitors and uses thereof | Nimbus Lakshimi, Inc. (US) | 2020-02-25 | — | — | US | disclosed |
| US-20190241577-A1 | TYK2 INHIBITORS AND USES THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2019-08-08 | — | — | US | disclosed |
| WO-2019023468-A1 | TYK2 INHIBITORS AND USES THEREOF | NIMBUS LAKSHMI, INC. (US) | 2019-01-31 | — | — | WO | disclosed |