SCHEMBL6667692

SCHEMBL6667692

CCCC1CCC(c2cc(F)c(C(F)(F)OC(C)c3ccc(C#N)c(F)c3)c(F)c2)CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CYP2C9 P11712 1/20 0.31
AR P10275 2/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM1A O60341 1/20 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
SCHEMBL6663818 0.94 CYP11B1 (0.31) CYP11B1CYP11B2KDM1A
SCHEMBL6664039 0.89 CYP2C9 (0.32) CYP11B1CYP11B2CYP2C9ARALDH1A1
SCHEMBL6661207 0.89 ALDH1A1 (0.36) CYP11B1CYP11B2CYP2C9ARALDH1A1
SCHEMBL6667890 0.88 MEN1 (0.33) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL6663203 0.88 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL6663216 0.87 NPSR1 (0.31) CYP2C9
SCHEMBL6663955 0.85 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL6664185 0.83 PDE2A (0.38)
SCHEMBL6661161 0.83 CYP11B1 (0.30) CYP11B1CYP11B2AR
SCHEMBL6667099 0.82 CYP11B1 (0.31) CYP11B1CYP11B2ALDH1A1LMNAMAPT

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