⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27675605 | 0.85 | TP53 (0.43) | — | |
| SCHEMBL10652688 | 0.81 | TP53 (0.50) | — | |
| SCHEMBL17713939 | 0.81 | TP53 (0.50) | — | |
| SCHEMBL3129006 | 0.78 | — | — | |
| SCHEMBL309721 | 0.76 | — | — | |
| SCHEMBL16235835 | 0.76 | — | — | |
| SCHEMBL28436800 | 0.76 | — | — | |
| SCHEMBL1043916 | 0.76 | — | — | |
| SCHEMBL150481 | 0.72 | HDAC1 (0.43) | — | |
| SCHEMBL1890320 | 0.72 | HDAC1 (0.43) | — |
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-102225924-B | Photoacid generators and photoresists comprising same | ROHM & HAAS ELECT MAT | 2015-04-01 | — | — | CN | disclosed |
| CN-102225924-A | Photoacid generators and photoresists comprising same | ROHM & HAAS ELECT MAT | 2011-10-26 | — | — | CN | disclosed |
| CN-100381421-C | Process for producing triarylsulfonium salt | WAKO PURE CHEM IND LTD (JP) | 2008-04-16 | — | — | CN | disclosed |
| CN-1871212-A | Process for producing triarylsulfonium salt | WAKO PURE CHEM IND LTD (JP) | 2006-11-29 | — | — | CN | disclosed |
| US-4062846-A | CNS STIMULANTS, MUSCLE RELAXANT | E. R. SQUIBB & SONS, INC. (US) | 1977-12-13 | — | — | US | disclosed |
| US-4022804-A | ADDITION REACTION; SULFONIC ACID BROMIDES, UNSATURATED COMPOUNDS | BASF AKTIENGESELLSCHAFT (DT) | 1977-05-10 | — | — | US | disclosed |
| US-3995042-A | MUSCLE RELAXANTS, CENTRAL NERVOUS SYSTEM STIMULANTS | E. R. SQUIBB & SONS, INC. (US) | 1976-11-30 | — | — | US | disclosed |
| US-3966733-A | CENTRAL NERVOUS SYSTEM STIMULANTS, MUSCLE RELAXANTS | E. R. SQUIBB & SONS, INC. (US) | 1976-06-29 | — | — | US | disclosed |
| US-3946025-A | MUSCLE RELAXANTS | E. R. SQUIBB & SONS, INC. (US) | 1976-03-23 | — | — | US | disclosed |