SCHEMBL5889438

SCHEMBL5889438

O=C1C=CC(=O)N1C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.35
GSK3A P49840 2/20 0.35
GSK3B P49841 2/20 0.35
TLR9 Q9NR96 1/20 0.35
FAAH O00519 2/20 0.32
ALDH1A1 P00352 2/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSP90AA1 P07900 1/20 0.30
HPGD P15428 1/20 0.30
XBP1 P17861 1/20 0.30
ALOX12 P18054 1/20 0.30
HTT P42858 1/20 0.30
RUNX1 Q01196 1/20 0.30
ATM Q13315 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
SCHEMBL9578152 0.83 MGLL (0.35) MGLLGSK3AGSK3BFAAHALDH1A1
SCHEMBL9578119 0.83 MGLL (0.35) MGLLGSK3AGSK3BFAAHALDH1A1
SCHEMBL9578155 0.81 MGLL (0.33) MGLLGSK3AGSK3BFAAH
SCHEMBL9578159 0.81 MGLL (0.33) MGLLGSK3AGSK3BFAAH
SCHEMBL21419589 0.78 MGLL (0.35) MGLLGSK3AGSK3BFAAHALDH1A1
SCHEMBL3482921 0.77 MGLL (0.38) MGLLGSK3AGSK3BTLR9FAAH
SCHEMBL9852613 0.76 MGLL (0.33) MGLLGSK3AGSK3BFAAH
SCHEMBL9852591 0.72 KDM4E (0.31)
SCHEMBL29181143 0.70 MGLL (0.35) MGLLGSK3AGSK3BALDH1A1GMNN
SCHEMBL3482453 0.70 TLR9 (0.30) TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7031589-B2 Material for attenuating light signals with low reflectance in a fiber optic network FURUKAWA ELECTRIC NORTH AMERICA (US) 2006-04-18 US claimed
US-20040264908-A1 Material for attenuating light signals with low reflectance in a fiber optic network FURUKAWA ELECTRIC NORTH AMERICA, INC. 2004-12-30 US claimed
US-7031589-B2 Material for attenuating light signals with low reflectance in a fiber optic network FURUKAWA ELECTRIC NORTH AMERICA (US) 2006-04-18 US disclosed
US-20040264908-A1 Material for attenuating light signals with low reflectance in a fiber optic network FURUKAWA ELECTRIC NORTH AMERICA, INC. 2004-12-30 US disclosed