SCHEMBL399989

SCHEMBL399989

C1#CCC2CC#CCC2C1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4073767 1.00
SCHEMBL6594618 0.74 ALDH1A1 (0.50)
Hydrogen Sulfide SCHEMBL873027 0.33
Xenon Xe 127 SCHEMBL29435140 0.33
SCHEMBL15482 0.33
SCHEMBL29449400 0.33
SCHEMBL29360521 0.33
SCHEMBL1394588 0.33
SCHEMBL10697375 0.33
SCHEMBL1658214 0.24

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 205 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4050084-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2024-07-03 EP claimed
EP-3307798-B2 ALIGNMENT COMPOUNDS TRANSITIONS OPTICAL INC (US) 2024-06-05 EP claimed
EP-4086325-B1 DYE-DOPED LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2024-05-22 EP claimed
EP-3668948-B1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2023-10-25 EP claimed
EP-3668947-B1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH FLAT OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2023-09-27 EP claimed
EP-3933009-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-08-16 EP claimed
EP-4056667-B1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-08-02 EP claimed
EP-3839008-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-07-26 EP claimed
EP-3638657-B1 DIBENZOFURAN DERIVATIVES AND DIBENZOTHIOPHENE DERIVATIVES MERCK PATENT GMBH (DE) 2022-07-20 EP claimed
EP-3307797-B1 ALIGNMENT POLYMERS TRANSITIONS OPTICAL INC (US) 2021-10-20 EP claimed
EP-0332007-B1 DERIVATIVES OF 2,3-DIFLUOROHYDROQUINONE MERCK PATENT GmbH (DE) 1992-11-25 EP claimed
EP-0290570-B1 CHIRAL OR ACHIRAL CYCLIC COMPOUNDS MERCK PATENT GmbH (DE) 1992-09-23 EP claimed
EP-0367771-B1 ARYL SULPHUR PENTAFLUORIDES MERCK PATENT GmbH (DE) 1992-09-02 EP claimed
EP-0313604-B1 ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT MERCK PATENT GmbH (DE) 1992-03-25 EP claimed
EP-0220297-B1 NITROGEN-CONTAINING HETEROCYCLES MERCK PATENT GmbH (DE) 1991-12-11 EP claimed
EP-0257049-B1 CHIRAL COMPOUNDS MERCK PATENT GmbH (DE) 1990-08-01 EP claimed
EP-0256097-B1 VINYL COMPOUNDS AND LIQUID CRYSTAL PHASE MERCK PATENT GmbH (DE) 1990-08-01 EP claimed
EP-0182054-B1 HETEROCYCLIC COMPOUNDS MERCK PATENT GmbH (DE) 1990-03-07 EP claimed
EP-0149238-B1 NITROGEN CONTAINING HETEROCYCLES MERCK PATENT GmbH (DE) 1990-02-28 EP claimed
EP-0216880-B1 CYCLOHEXANE DERIVATIVES MERCK PATENT GmbH (DE) 1988-11-02 EP claimed