⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL294463 | 1.00 | — | — | |
| SCHEMBL294462 | 1.00 | — | — | |
| SCHEMBL293646 | 0.81 | — | — | |
| SCHEMBL293647 | 0.81 | — | — | |
| SCHEMBL437922 | 0.75 | — | — | |
| SCHEMBL294782 | 0.75 | — | — | |
| SCHEMBL294783 | 0.75 | — | — | |
| SCHEMBL14197614 | 0.72 | — | — | |
| SCHEMBL6722145 | 0.72 | — | — | |
| SCHEMBL1475674 | 0.72 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7087272-B2 | negative anisotropy of the dielectric constants; liquid-crystalline media and optical and electro-optical display elements | MERCK PATENT GMBH (DE) | 2006-08-08 | — | — | US | disclosed |
| US-7029730-B2 | components of liquid-crystalline media, in particular for displays based on the twisted cell principle, the guest-host effect, the deformation of aligned phases, electrically controlled birefringence, color super homeotropic, vertically aligned or in plane switching effect or dynamic scattering effect | MERCK PATENT GMBH (DE) | 2006-04-18 | — | — | US | disclosed |
| US-6916513-B2 | High dielectric anisotropy and low birefringence; liquid crystal mixtures | MERCK PATENT GMBH (DE) | 2005-07-12 | — | — | US | disclosed |
| US-6875894-B2 | Electrophilic activity; fluorination, alkylation to nucleophilic compounds | MERCK PATENT GMBH (DE) | 2005-04-05 | — | — | US | disclosed |
| US-20040167361-A1 | Compounds of liquid crystal structure for optical devices | MERCK PATENT GMBH (DE) | 2004-08-26 | — | — | US | disclosed |
| US-20040106798-A1 | negative anisotropy of the dielectric constants; liquid-crystalline media and optical and electro-optical display elements | MERCK PATENT GMBH (DE) | 2004-06-03 | — | — | US | disclosed |
| US-20040063985-A1 | Bis(alkylthio)carbenium salts | MERCK PATENT GMBH (DE) | 2004-04-01 | — | — | US | disclosed |
| EP-1373434-A1 | FLUORINATED FLUORENE DERIVATIVES | MERCK PATENT GmbH (DE) | 2004-01-02 | — | — | EP | disclosed |
| EP-1373175-A2 | 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES | MERCK PATENT GmbH (DE) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002098832-A1 | CF2O-BRIDGED, AXIALLY SUBSTITUTED CYCLOHEXANE DERIVATIVES. | MERCK PATENT GMBH (DE) | 2002-12-12 | — | — | WO | disclosed |
| WO-2002081418-A2 | 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES | MERCK PATENT GMBH (DE) | 2002-10-17 | — | — | WO | disclosed |
| WO-2002079344-A1 | FLUORINATED FLUORENE DERIVATIVES | MERCK PATENT GMBH (DE) | 2002-10-10 | — | — | WO | disclosed |
| WO-2002064583-A2 | BIS(ALKYLTHIO)CARBENIUM SALTS | MERCK PATENT GMBH (DE) | 2002-08-22 | — | — | WO | disclosed |