SCHEMBL16803189

SCHEMBL16803189

CCCC1CCC(C2CCC(C3CCC(CCO)CC3CC)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.35

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
SCHEMBL14555138 0.98 TLR4 (0.33) TLR4
SCHEMBL16803187 0.94 TLR4 (0.37) TLR4
SCHEMBL16803214 0.91 TLR4 (0.33) TLR4
SCHEMBL16803112 0.90
SCHEMBL16803212 0.90 PKM (0.33)
SCHEMBL16803211 0.89 TLR4 (0.35) TLR4
SCHEMBL14555131 0.88 CYP1A2 (0.33)
SCHEMBL16803113 0.88
SCHEMBL14555129 0.87 TLR4 (0.33) TLR4
SCHEMBL14555071 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2883934-A1 Liquid-crystalline medium Merck Patent GmbH (DE) 2015-06-17 EP disclosed