SCHEMBL6461043

SCHEMBL6461043

CCCCC1CCC2CC(c3ccc(-c4cc(F)c(OC)c(F)c4)c(F)c3)CCC2C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.32
FFAR1 O14842 1/20 0.31
KDM1A O60341 2/20 0.30

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
SCHEMBL6461040 1.00 FASN (0.32) FASNFFAR1KDM1A
SCHEMBL6461531 0.97 FASN (0.32) FASNFFAR1
SCHEMBL6461534 0.97 FASN (0.32) FASNFFAR1
SCHEMBL6452889 0.96 FASN (0.31) FASNFFAR1
SCHEMBL6452887 0.96 FASN (0.31) FASNFFAR1
SCHEMBL6459082 0.96 FASN (0.31) FASNFFAR1
SCHEMBL6459079 0.96 FASN (0.31) FASNFFAR1
SCHEMBL6457219 0.94 FASN (0.33) FASNFFAR1KDM1A
SCHEMBL6457216 0.94 FASN (0.33) FASNFFAR1KDM1A
SCHEMBL6456934 0.91 FASN (0.31) FASN

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