SCHEMBL2664110

SCHEMBL2664110

NNC(=O)c1ccc(O)c(OC(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.54
GCGR P47871 1/20 0.47
BLM P54132 2/20 0.44
MPO P05164 1/20 0.44
CYP3A4 P08684 1/20 0.44
KDM5A P29375 1/20 0.44
GFER P55789 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPT P10636 2/20 0.43
GAA P10253 2/20 0.43
NSD2 O96028 1/20 0.43
LMNA P02545 1/20 0.43
ALPL P05186 1/20 0.43
POLB P06746 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
APEX1 P27695 1/20 0.43

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
SCHEMBL3641624 0.82 APP (0.50) APPGCGRHTTKMT2A
SCHEMBL2663965 0.82 ALDH1A1 (0.51) BLMMPOCYP3A4KDM5AGFER
SCHEMBL3648979 0.80 HTT (0.61) APPGCGRALDH1A1KDM4EMAPT
SCHEMBL10321468 0.79 CA12 (0.59) APPGCGRALDH1A1KDM4EMAPT
SCHEMBL2664428 0.79 MEN1 (0.66) BLMALDH1A1KDM4EMAPTGAA
SCHEMBL10322973 0.79 APP (0.50) APPGCGRLMNAHTTKMT2A
SCHEMBL24436791 0.78 APP (0.50) APPGCGRBLMALDH1A1KDM4E
SCHEMBL2650529 0.75 TRPV1 (0.59) BLMMPOCYP3A4KDM5AGFER
SCHEMBL14556328 0.74 TTR (0.53) APPALDH1A1KDM4EMAPTPOLB
SCHEMBL2664433 0.74 HDAC6 (0.67) BLMMPOCYP3A4KDM5AGFER

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
WO-1999001423-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 1999-01-14 WO disclosed