SCHEMBL7766893

SCHEMBL7766893

CC=CCOC1CCC(C2CCC(C3CCC(CCC)CC3)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
SCHEMBL7766888 1.00 TLR4 (0.35) TLR4
SCHEMBL10448040 1.00 TLR4 (0.35) TLR4
SCHEMBL7766891 1.00 TLR4 (0.35) TLR4
SCHEMBL7766896 1.00 TLR4 (0.35) TLR4
SCHEMBL7770604 1.00 TLR4 (0.35) TLR4
SCHEMBL8215253 0.93 TLR4 (0.31) TLR4
SCHEMBL7723578 0.93 TLR4 (0.31) TLR4
SCHEMBL7723575 0.93 TLR4 (0.31) TLR4
SCHEMBL8216157 0.89 CYP2C9 (0.30)
SCHEMBL8216159 0.89 CYP2C9 (0.30)

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-0747336-B1 Alkenyl cyclohexane derivatives and liquid crystal compositions CHISSO CORP (JP) 2001-07-25 EP disclosed
US-5709820-A MIXTURES CHISSO CORPORATION (JP) 1998-01-20 US disclosed
EP-0747336-A1 Alkenyl cyclohexane derivatives and liquid crystal compositions Chisso Corporation (JP) 1996-12-11 EP disclosed