⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5149048 | 0.97 | — | — | |
| SCHEMBL10233825 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6511711 | 0.79 | — | — | |
| SCHEMBL71836 | 0.78 | — | — | |
| SCHEMBL3106063 | 0.73 | ALDH1A1 (0.43) | — | |
| Bromide SCHEMBL6622782 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL8308716 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL457944 | 0.73 | — | — | |
| SCHEMBL22111960 | 0.72 | — | — | |
| SCHEMBL1702980 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230365605-A1 | BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF | WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT | 2023-11-16 | — | — | US | disclosed |
| WO-2022146698-A1 | SOS1 INHIBITORS AND USES THEREOF | Revolution Medicines, Inc. (US) | 2022-07-07 | — | — | WO | disclosed |
| US-20220162504-A1 | Polymerisable Liquid Crystal Material and Polymerised Liquid Crystal Film | MERCK PATENT GMBH (DE) | 2022-05-26 | — | — | US | disclosed |
| WO-2022076496-A1 | PREPARATION OF OXINDOLE DERIVATIVES AS NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2022-04-14 | — | — | WO | disclosed |
| US-10435628-B2 | Polymerisable LC medium and polymer film with negative optical dispersion | MERCK PATENT GMBH (DE) | 2019-10-08 | — | — | US | disclosed |
| US-20170226421-A1 | POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION | MERCK PATENT GMBH (DE) | 2017-08-10 | — | — | US | disclosed |
| US-9725427-B2 | Prodrugs of riluzole and their method of use | Biohaven Pharmaceutical Holding Company Limited (US) | 2017-08-08 | — | — | US | disclosed |
| US-20150045401-A1 | PRODRUGS OF RILUZOLE AND THEIR METHOD OF USE | BEETLEJUICE SA LLC, AS PURCHASER AGENT | 2015-02-12 | — | — | US | disclosed |
| CN-1871237-A | 2-cyanopyrrolidinecarboxamides as dipeptidyl peptidase-IV inhibitors | ASTELLAS PHARMA INC (JP) | 2006-11-29 | — | — | CN | disclosed |