SCHEMBL8052272

SCHEMBL8052272

C/C=C/CCC1=CCC(C2CCC(CCCCC)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.32

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
SCHEMBL8052275 1.00 TLR4 (0.32) TLR4
SCHEMBL8055094 0.99 CYP3A4 (0.31) TLR4
SCHEMBL8055092 0.99 CYP3A4 (0.31) TLR4
SCHEMBL8052561 0.90 TLR4 (0.38) TLR4
SCHEMBL8052563 0.90 TLR4 (0.38) TLR4
SCHEMBL8049193 0.89 SPHK1 (0.32)
SCHEMBL8049190 0.89 SPHK1 (0.32)
SCHEMBL8037737 0.86 CYP3A4 (0.30) TLR4
SCHEMBL9649549 0.86 TLR4 (0.33) TLR4
SCHEMBL9649531 0.86 TLR4 (0.33) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728829-B1 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2000-05-03 EP disclosed
US-5698136-A LOW TEMPERATURE COMPATIBILITY, CHEMICAL STABILITY CHISSO CORPORATION (JP) 1997-12-16 US disclosed
EP-0728829-A2 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1996-08-28 EP disclosed