SCHEMBL6464689

SCHEMBL6464689

CCCC1CCC2CC(C3CCC4CC(C=O)CCC4C3)CCC2C1

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
SCHEMBL6464686 1.00 TLR4 (0.35) TLR4
SCHEMBL6453263 0.98 TLR4 (0.35) TLR4
SCHEMBL6458146 0.98 TLR4 (0.35) TLR4
SCHEMBL10837428 0.98 TLR4 (0.35) TLR4
SCHEMBL6453271 0.98 TLR4 (0.35) TLR4
SCHEMBL6455038 0.93 TLR4 (0.40) TLR4
SCHEMBL30846912 0.93 TLR4 (0.38) TLR4
SCHEMBL6455041 0.93 TLR4 (0.40) TLR4
SCHEMBL6460753 0.93 TLR4 (0.38) TLR4
SCHEMBL6460758 0.93 TLR4 (0.38) 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-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed