⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9670406 | 0.78 | — | — | |
| SCHEMBL19632759 | 0.75 | — | — | |
| SCHEMBL10787037 | 0.75 | LMNA (0.30) | — | |
| SCHEMBL8027929 | 0.72 | HTT (0.33) | — | |
| SCHEMBL10291272 | 0.72 | — | — | |
| SCHEMBL8617011 | 0.72 | HTT (0.33) | — | |
| SCHEMBL8018447 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL152381 | 0.72 | — | — | |
| SCHEMBL28301271 | 0.69 | — | — | |
| SCHEMBL136829 | 0.69 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113292392-A | Rearrangement reaction between saturated hydrochlorofluorocarbons and method for preparing fluoroalcohol by using rearrangement reaction | 台州益普高分子材料有限公司 | 2021-08-24 | — | — | CN | disclosed |
| US-9809578-B2 | Pyrazolyl urea, thiourea, guanidine and cyanoguanidine compounds as trkA kinase inhibitors | ARRAY BIOPHARMA INC. (US) | 2017-11-07 | — | — | US | disclosed |
| US-20160280690-A1 | PYRAZOLYL UREA, THIOUREA, GUANIDINE AND CYANOGUANIDINE COMPOUNDS AS TRKA KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2016-09-29 | — | — | US | disclosed |
| WO-2014078417-A1 | PYRAZOLYL UREA, THIOUREA, GUANIDINE AND CYANOGUANIDINE COMPOUNDS AS TRKA KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2014-05-22 | — | — | WO | disclosed |