SCHEMBL12698777

SCHEMBL12698777

CC1CCC(C2CCC(COC3CC4CCC(C)OC4C(F)C3F)CC2)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
SCHEMBL12351464 0.99 — —
SCHEMBL16855485 0.86 — —
SCHEMBL14156247 0.86 — —
SCHEMBL16803179 0.85 — —
SCHEMBL12321822 0.84 — —
SCHEMBL9972370 0.78 — —
SCHEMBL20248291 0.76 — —
SCHEMBL20821894 0.75 — —
SCHEMBL15221197 0.75 — —
SCHEMBL20248296 0.74 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183571-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-06-15 — — US disclosed
US-11667845-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2023-06-06 — — US disclosed
US-20180163137-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2018-06-14 — — US disclosed
US-20170362506-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-12-21 — — US disclosed
EP-3235894-A2 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2017-10-25 — — EP disclosed
EP-2691490-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-07-26 — — EP disclosed
EP-3130650-A1 LIQUID-CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2017-02-15 — — EP disclosed
EP-2677018-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-11-23 — — EP disclosed
US-20120305843-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-12-06 — — US disclosed
WO-2012126562-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-09-27 — — WO disclosed
WO-2010072370-A1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2010-07-01 — — WO disclosed
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