SCHEMBL6663216

SCHEMBL6663216

CCCC1CCC(c2cc(F)c(C(F)(F)OC(C)c3cc(F)c(C#N)c(F)c3)c(F)c2)CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.31
CYP2C9 P11712 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
SCHEMBL6663967 0.93
SCHEMBL6663955 0.89 CYP2C9 (0.34) CYP2C9
SCHEMBL6661341 0.87 CYP2C9 (0.33) NPSR1CYP2C9
SCHEMBL6667692 0.87 CYP11B1 (0.32) CYP2C9
SCHEMBL6666944 0.87 ALDH1A1 (0.38) NPSR1CYP2C9
SCHEMBL6667890 0.87 MEN1 (0.33) CYP2C9
SCHEMBL6661871 0.84 CYP2C9 (0.31) CYP2C9
SCHEMBL6663203 0.84 CYP2C9 (0.34) CYP2C9
SCHEMBL7722615 0.83 CYP2C9 (0.33) CYP2C9
SCHEMBL7722620 0.83 CYP2C9 (0.33) CYP2C9

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