⚠ 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 SCHEMBL28264725 | 0.97 | TSHR (0.67) | — | |
| SCHEMBL51016 | 0.97 | — | — | |
| SCHEMBL11895200 | 0.97 | TSHR (0.74) | — | |
| Fluoride SCHEMBL27915980 | 0.95 | — | — | |
| Butane SCHEMBL28292472 | 0.95 | TSHR (0.70) | — | |
| SCHEMBL23358382 | 0.95 | — | — | |
| SCHEMBL27442936 | 0.95 | — | — | |
| Water SCHEMBL27663607 | 0.95 | — | — | |
| SCHEMBL6907380 | 0.95 | — | — | |
| SCHEMBL28159655 | 0.95 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-120078798-A | Targeting myeloid immune checkpoint c-Rel medicament and application thereof | 深圳先进技术研究院 | 2025-06-03 | — | — | CN | disclosed |
| CN-106796988-B | Method for producing layers of organic perovskite material with improved crystallinity | 牛津大学科技创新有限公司 | 2019-04-23 | — | — | CN | disclosed |
| CN-107532077-A | Cosurfactant formation of foam composition for intensified oil reduction | 陶氏环球技术有限责任公司 | 2018-01-02 | — | — | CN | disclosed |
| CN-106796988-A | Method for producing layers of organic perovskite material with improved crystallinity | 牛津大学科技创新有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-106660970-A | Quinazoline derivative | 石药集团中奇制药技术（石家庄）有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-105017240-A | Pesticidal compositions | DOW AGROSCIENCES LLC | 2015-11-04 | — | — | CN | disclosed |
| CN-1270598-A | Methods and compounds for analyzing nucleic acids by mass spectrometry | RAPIGENE INC (US) | 2000-10-18 | — | — | CN | disclosed |