SCHEMBL6663487

SCHEMBL6663487

C=CCC[C@H]1CC[C@H](CC(F)(F)OCc2ccc(C(F)(F)F)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.33
FFAR1 O14842 1/20 0.31
DAO P14920 1/20 0.31
DRD4 P21917 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL6664174 0.90 GRM2 (0.32)
SCHEMBL6664181 0.90 GRM2 (0.32)
SCHEMBL6665088 0.87 FFAR1 (0.32) KIF11FFAR1DAODRD4
SCHEMBL6665093 0.87 FFAR1 (0.32) KIF11FFAR1DAODRD4
SCHEMBL6661931 0.86
SCHEMBL6662902 0.84
SCHEMBL6662894 0.84
SCHEMBL6667318 0.84 P2RX7 (0.36)
SCHEMBL6666993 0.84 KDM1A (0.33) KIF11KDM1A
SCHEMBL6663931 0.84 RORC (0.37) DAOKDM1A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed