⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4858733 | 0.91 | — | — | |
| SCHEMBL1157741 | 0.91 | — | — | |
| SCHEMBL27667833 | 0.83 | — | — | |
| SCHEMBL29044827 | 0.83 | — | — | |
| SCHEMBL18939243 | 0.83 | — | — | |
| SCHEMBL28581005 | 0.83 | — | — | |
| Potassium Ion SCHEMBL31215176 | 0.83 | — | — | |
| Potassium Ion SCHEMBL28393878 | 0.83 | — | — | |
| SCHEMBL16047646 | 0.82 | — | — | |
| SCHEMBL63026 | 0.82 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107628629-B | Compound cesium rubidium fluoroborate, nonlinear optical crystal of cesium rubidium fluoroborate, preparation method and application | 中国科学院新疆理化技术研究所 | 2020-04-10 | — | — | CN | claimed |
| CN-114197043-B | Compound potassium cesium iodine fluoroborate and potassium cesium iodine fluoroborate nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2023-07-25 | — | — | CN | disclosed |
| CN-116288710-A | Compound rubidium ammonium fluoroborate and rubidium ammonium fluoroborate nonlinear optical crystal, and preparation method and application thereof | 中国科学院新疆理化技术研究所 | 2023-06-23 | — | — | CN | disclosed |
| CN-114197043-A | Compound potassium cesium fluoroborate iodine, potassium cesium fluoroborate iodine nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2022-03-18 | — | — | CN | disclosed |
| CN-114057207-A | Compound sodium octaborate decafluoride, sodium octaborate decafluoride nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2022-02-18 | — | — | CN | disclosed |
| CN-111334858-B | Compound barium fluoborate, barium fluoborate nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2021-06-29 | — | — | CN | disclosed |
| CN-113046822-A | Rubidium aluminum fluoborate nonlinear optical crystal and preparation method and application thereof | 河北大学 | 2021-06-29 | — | — | CN | disclosed |
| CN-110725004-B | Cesium rubidium fluoroboroaluminate nonlinear optical crystal and preparation method and application thereof | 河北大学 | 2021-04-20 | — | — | CN | disclosed |
| CN-111139524-B | Potassium fluoborate, potassium fluoborate nonlinear optical crystal, preparation method and application | 韩悦潼 | 2020-09-11 | — | — | CN | disclosed |
| CN-111334858-A | Compound barium fluoborate, barium fluoborate nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2020-06-26 | — | — | CN | disclosed |
| CN-111139524-A | Potassium fluoborate, potassium fluoborate nonlinear optical crystal, preparation method and application | 韩悦潼 | 2020-05-12 | — | — | CN | disclosed |
| CN-107628629-B | Compound cesium rubidium fluoroborate, nonlinear optical crystal of cesium rubidium fluoroborate, preparation method and application | 中国科学院新疆理化技术研究所 | 2020-04-10 | — | — | CN | disclosed |
| CN-107628629-B | Compound cesium rubidium fluoroborate, nonlinear optical crystal of cesium rubidium fluoroborate, preparation method and application | 中国科学院新疆理化技术研究所 | 2020-04-10 | — | — | CN | disclosed |
| CN-107628629-B | Compound cesium rubidium fluoroborate, nonlinear optical crystal of cesium rubidium fluoroborate, preparation method and application | 中国科学院新疆理化技术研究所 | 2020-04-10 | — | — | CN | disclosed |
| CN-110725004-A | Cesium rubidium fluoroboroaluminate nonlinear optical crystal and preparation method and application thereof | 河北大学 | 2020-01-24 | — | — | CN | disclosed |