SCHEMBL6456971

SCHEMBL6456971

CCC1CCC2CC(c3ccc(-c4cc(F)c(OC)c(F)c4)c(F)c3)CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.33
KDM1A O60341 2/20 0.32
FASN P49327 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
SCHEMBL6456968 1.00 FFAR1 (0.33) FFAR1KDM1AFASN
SCHEMBL6457216 0.91 FASN (0.33) FFAR1KDM1AFASN
SCHEMBL6457219 0.91 FASN (0.33) FFAR1KDM1AFASN
SCHEMBL6458335 0.90 FASN (0.31) FASN
SCHEMBL6458340 0.90 FASN (0.31) FASN
SCHEMBL6461040 0.89 FASN (0.32) FFAR1KDM1AFASN
SCHEMBL6461043 0.89 FASN (0.32) FFAR1KDM1AFASN
SCHEMBL6461531 0.89 FASN (0.32) FFAR1FASN
SCHEMBL6461534 0.89 FASN (0.32) FFAR1FASN
SCHEMBL6457571 0.89 FASN (0.34) 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