SCHEMBL10048437

SCHEMBL10048437

CCCC1CCC(C2CCC(C3CCC(I)C(F)C3F)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 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
SCHEMBL16071985 0.89
SCHEMBL16072163 0.89
SCHEMBL16071716 0.89
SCHEMBL17620928 0.89 TLR4 (0.33) TLR4
SCHEMBL16072207 0.84
SCHEMBL16072194 0.84
SCHEMBL17620927 0.84 TLR4 (0.31) TLR4
SCHEMBL10016650 0.83 TLR4 (0.31) TLR4
SCHEMBL17120513 0.83 TLR4 (0.31) TLR4
SCHEMBL16072169 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012038026-A1 LIQUID CRYSTAL DISPLAYS AND LIQUID CRYSTALLINE MEDIA WITH HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2012-03-29 WO disclosed
WO-2011160765-A1 POLYMERIZIBLE COMPOUNDS AND USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2011-12-29 WO disclosed
WO-2011050893-A1 POLYMERIZABLE COMPOUNDS AND USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2011-05-05 WO disclosed