SCHEMBL4399716

SCHEMBL4399716

NC(=O)Oc1ccc(CC(=O)Nc2ccc(SC(F)F)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.67
MAPT P10636 5/20 0.67
MEN1 O00255 4/20 0.67
LMNA P02545 8/20 0.67
SMN1; SMN2 Q16637 8/20 0.67
GAA P10253 5/20 0.67
RAB9A P51151 5/20 0.67
NPC1 O15118 4/20 0.67
HTT P42858 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MAP4K4 O95819 1/20 0.56
ABL1 P00519 1/20 0.56
NTRK1 P04629 1/20 0.56
LCK P06239 1/20 0.56
FYN P06241 1/20 0.56
CSF1R P07333 1/20 0.56
RET P07949 1/20 0.56
IGF1R P08069 1/20 0.56
PDGFRB P09619 1/20 0.56
FGFR1 P11362 1/20 0.56

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
SCHEMBL2287139 0.83 MEN1 (0.76) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2281678 0.83 KMT2A (0.61) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL15520341 0.82 SMN1; SMN2 (0.82) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2284438 0.81 MEN1 (0.76) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2978654 0.80 KMT2A (0.56) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2284419 0.79 MAPT (0.62) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2284674 0.78 MAPT (0.70) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2291510 0.78 LMNA (0.69) KMT2AMAPTMEN1LMNASMN1; SMN2
Trifluoroacetic Acid SCHEMBL2284572 0.77 LMNA (0.69) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL2281683 0.77 MEN1 (0.66) KMT2AMAPTMEN1LMNASMN1; SMN2

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-2009145996-A2 AMIDE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-12-03 WO disclosed