⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27530748 | 0.95 | CES2 (0.42) | — | |
| SCHEMBL14763815 | 0.93 | CES2 (0.46) | — | |
| SCHEMBL6881837 | 0.93 | CES2 (0.46) | — | |
| SCHEMBL6939540 | 0.90 | ELANE (0.34) | — | |
| SCHEMBL11239979 | 0.90 | — | — | |
| SCHEMBL28794830 | 0.83 | BTK (0.39) | — | |
| SCHEMBL13843721 | 0.82 | AAK1 (0.34) | — | |
| SCHEMBL27755064 | 0.81 | LMNA (0.40) | — | |
| SCHEMBL27991990 | 0.79 | GABRA5 (0.48) | — | |
| SCHEMBL6451745 | 0.79 | CHRNB2 (0.32) | — |
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-108129288-B | Synthesis method of trans-3-hydroxycyclobutylformic acid | 上海毕得医药科技股份有限公司 | 2021-01-22 | — | — | CN | disclosed |
| CN-108129288-A | A kind of synthetic method of trans- -3- hydroxycyclobutyls formic acid | 上海毕得医药科技有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-107903161-A | A kind of synthetic method of cis 3 hydroxycyclobutyl formic acid | 上海毕路得医药科技有限公司 | 2018-04-13 | — | — | CN | disclosed |
| US-7598281-B2 | Arylcycloakyl-substituted alkanoic acid derivatives useful as peroxisome proliferator-activated receptor (PPAR) ligands for the treatment of hyperlipidemia and diabetes | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2009-10-06 | — | — | US | disclosed |