⚠ 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 SCHEMBL30870498 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL27433902 | 0.93 | — | — | |
| Bromide SCHEMBL31196810 | 0.93 | — | — | |
| Methane SCHEMBL11198559 | 0.93 | — | — | |
| SCHEMBL30863734 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL27692480 | 0.93 | — | — | |
| Ethane SCHEMBL6980869 | 0.90 | — | — | |
| SCHEMBL2326360 | 0.87 | HCAR2 (0.38) | — | |
| SCHEMBL27541628 | 0.80 | HCAR2 (0.39) | — | |
| Acetic Acid SCHEMBL19086689 | 0.80 | HCAR2 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109414442-B | Liquid preparation of compound | 洛克索肿瘤学股份有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-113354649-A | Novel crystal form | 阵列生物制药公司 | 2021-09-07 | — | — | CN | disclosed |
| CN-107428760-B | Crystalline forms of (S) -N- (5- ((R) -2- (2, 5-difluorophenyl) -pyrrolidin-1-yl) -pyrazolo [1,5-a ] pyrimidin-3-yl) -3-hydroxypyrrolidine-1-carboxamide hydrogen sulfate | 阵列生物制药公司 | 2021-04-27 | — | — | CN | disclosed |