SCHEMBL17620928

SCHEMBL17620928

CCCC1CCC(C2CCC(C3CCC(CCC)CC3)C(F)C2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL17620927 0.94 TLR4 (0.31) TLR4
SCHEMBL17620926 0.92 TLR4 (0.30) TLR4
SCHEMBL16071700 0.91
SCHEMBL17620922 0.91
SCHEMBL17621178 0.89
SCHEMBL10016650 0.89 TLR4 (0.31) TLR4
SCHEMBL17120513 0.89 TLR4 (0.31) TLR4
SCHEMBL17620772 0.89
SCHEMBL17620930 0.89 CYP1A2 (0.38) CYP1A2CYP2C9
SCHEMBL10048437 0.89 TLR4 (0.31) TLR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580652-B2 Liquid crystal compound, liquid crystal composition including the same and liquid crystal display including the liquid crystal composition SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-20160083653-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME AND LIQUID CRYSTAL DISPLAY INCLUDING THE LIQUID CRYSTAL COMPOSITION SAMSUNG DISPLAY CO., LTD. (KR) 2016-03-24 US disclosed