⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16233599 | 0.78 | — | — | |
| SCHEMBL10907446 | 0.75 | — | — | |
| SCHEMBL10885484 | 0.75 | — | — | |
| SCHEMBL10486984 | 0.73 | KDM4E (0.31) | — | |
| SCHEMBL424258 | 0.73 | — | — | |
| SCHEMBL7210794 | 0.71 | — | — | |
| SCHEMBL24309070 | 0.69 | KDM4E (0.32) | — | |
| SCHEMBL10485183 | 0.69 | — | — | |
| SCHEMBL14414137 | 0.69 | DPP4 (0.30) | — | |
| SCHEMBL8508595 | 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 |
|---|---|---|---|---|---|---|---|
| EP-3166939-B1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH INC (US) | 2019-06-05 | — | — | EP | disclosed |
| US-20090299111-A1 | (ALKYLPHENYL) ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL) ALKYLCYCLOHEXANE OR ALKYLBIPHENYL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2009-12-03 | — | — | US | disclosed |
| CN-101228102-A | (alkylphenyl)alkylcyclohexane and method for producing (alkylphenyl)alkylcyclohexane or alkylbiphenyl | MITSUBISHI GAS CHEMICAL CO (JP) | 2008-07-23 | — | — | CN | disclosed |
| EP-1908743-A1 | (ALKYLPHENYL)ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL)ALKYLCYCLOHEXANE OR ALKYLBIPHENYL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2008-04-09 | — | — | EP | disclosed |