SCHEMBL1067459

SCHEMBL1067459

FC(F)Oc1cc[c]c(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALOX15 P16050 1/20 0.33
GFER P55789 1/20 0.33
ADAM17 P78536 1/20 0.33
DRD1 P21728 2/20 0.32
EPHX2 P34913 1/20 0.32
SCN5A Q14524 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 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
SCHEMBL3284666 0.84 PDK2 (0.37) MEN1MAPTKMT2A
SCHEMBL1066922 0.81 GPR3 (0.40) LMNAMAPTSMN1; SMN2ALOX15EPHX2
SCHEMBL3695599 0.78 KIF11 (0.33)
SCHEMBL160639 0.77 PGR (0.36) MAPTSMN1; SMN2NPSR1EPHX2
SCHEMBL1067710 0.75 GPR3 (0.33) MEN1LMNAMAPTHTTKMT2A
SCHEMBL1067722 0.75 ALOX15 (0.39) MEN1LMNAMAPTHTTKMT2A
SCHEMBL900568 0.75 ALOX15 (0.35) MEN1LMNAMAPTHTTKMT2A
SCHEMBL900731 0.75 ALOX15 (0.35) MEN1LMNAMAPTHTTKMT2A
SCHEMBL1067511 0.73 ALOX15 (0.34) MEN1LMNAMAPTHTTKMT2A
SCHEMBL1067134 0.73 ALOX15 (0.34) MEN1LMNAMAPTHTTKMT2A

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
WO-2011006886-A2 AZOLE COMPOUNDS CARRYING A SULFUR SUBSTITUENT XIV BASF SE (DE) 2011-01-20 WO disclosed
WO-2010149758-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES BASF SE (DE) 2010-12-29 WO disclosed