⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1990694 | 0.84 | — | — | |
| SCHEMBL1990236 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL404187 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL1803311 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL8637856 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL9798382 | 0.72 | — | — | |
| SCHEMBL7635866 | 0.70 | — | — | |
| SCHEMBL7628169 | 0.70 | — | — | |
| SCHEMBL166827 | 0.70 | — | — | |
| SCHEMBL246615 | 0.70 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6203671-B1 | REACTING A MOLAR EXCESS OF AN ALIPHATIC STARTING COMPOUND IN LIQUID PHASE WITH FLUORINE IN PRESENCE OF ULTRAVIOLET RADIATION TO PRODUCE PRODUCT MIXTURE CONTAINING FLUORINATED PRODUCT HAVING HYDROGEN ATOM; RECOVERING PRODUCT | ALLIEDSIGNAL INC. | 2001-03-20 | — | — | US | claimed |
| CN-113527045-A | Preparation method of chlorofluoropropane | 浙江省化工研究院有限公司 | 2021-10-22 | — | — | CN | disclosed |
| CN-113527040-A | Preparation method of halogenated propylene | 浙江省化工研究院有限公司 | 2021-10-22 | — | — | CN | disclosed |
| EP-1159239-A1 | METHOD OF PRODUCING FLUORINATED COMPOUNDS | AlliedSignal Inc. (US) | 2001-12-05 | — | — | EP | disclosed |
| US-6203671-B1 | REACTING A MOLAR EXCESS OF AN ALIPHATIC STARTING COMPOUND IN LIQUID PHASE WITH FLUORINE IN PRESENCE OF ULTRAVIOLET RADIATION TO PRODUCE PRODUCT MIXTURE CONTAINING FLUORINATED PRODUCT HAVING HYDROGEN ATOM; RECOVERING PRODUCT | ALLIEDSIGNAL INC. | 2001-03-20 | — | — | US | disclosed |
| WO-2000053549-A1 | METHOD OF PRODUCING FLUORINATED COMPOUNDS | ALLIEDSIGNAL INC. (US) | 2000-09-14 | — | — | WO | disclosed |
| US-5490390-A | USING PERHALOGENATED, FLUORINE CONTAINING ALKANES AS HEAT TRANSFER LIQUIDS IN MULTI-LOOP SYSTEM | PPG INDUSTRIES, INC. (US) | 1996-02-13 | — | — | US | disclosed |
| WO-1995031679-A1 | LIQUEFACTION OF CHLORINE OR OTHER SUBSTANCES | PPG INDUSTRIES, INC. (US) | 1995-11-23 | — | — | WO | disclosed |