SCHEMBL12075661

SCHEMBL12075661

C=CC(CCC)CCCC1CCC(C2CCC(OC)C(F)C2F)CC1

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
SCHEMBL18258057 0.85 — —
SCHEMBL15128246 0.85 — —
SCHEMBL16378173 0.83 MAPT (0.39) —
SCHEMBL15250406 0.83 MAPT (0.39) —
SCHEMBL15062104 0.81 CYP1A2 (0.38) —
SCHEMBL16168445 0.81 — —
SCHEMBL17620924 0.79 — —
SCHEMBL17621177 0.77 — —
SCHEMBL17620776 0.77 — —
SCHEMBL18509625 0.77 — —

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3029127-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2017-12-20 — — EP disclosed
EP-3124465-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-02-01 — — EP disclosed
WO-2016184542-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2016-11-24 — — WO disclosed
WO-2016116119-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-07-28 — — WO disclosed
EP-2990460-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2016-03-02 — — EP disclosed
EP-2937401-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2015-10-28 — — EP disclosed
EP-2534223-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-10-21 — — EP disclosed
EP-2593529-B1 LIQUID CRYSTALLINE MEDIA AND LIQUID CRYSTAL DISPLAYS WITH A POLYMER-STABILIZED HOMEOTROPIC ORIENTATION MERCK PATENT GMBH (DE) 2015-10-14 — — EP disclosed
EP-2921545-A2 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2015-09-23 — — EP disclosed
EP-2542647-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-09-16 — — EP disclosed
EP-2483370-B1 POLYMERIZABLE COMPOUNDS AND THEIR USE IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2015-07-15 — — EP disclosed
EP-2686402-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-03-25 — — EP disclosed
WO-2014079517-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-05-30 — — WO disclosed
EP-2380945-B1 Polymerisable compounds and use of same in liquid crystal media and liquid crystal displays MERCK PATENT GMBH (DE) 2014-05-14 — — EP disclosed
EP-2208774-B1 Liquid crystalline medium MERCK PATENT GMBH (DE) 2012-08-29 — — EP disclosed
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