SCHEMBL8291350

SCHEMBL8291350

CC(C)(CCc1ccc(-c2ccc([N+](=O)[O-])c(N)c2)cc1)[Si](C)(C)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.39
MAPT P10636 6/20 0.39
TDP1 Q9NUW8 3/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.34
SIRT6 Q8N6T7 1/20 0.34
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
MCL1 Q07820 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ADRB2 P07550 1/20 0.33

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
SCHEMBL8291332 0.80 TDP1 (0.35) MAPTTDP1MEN1POLBKMT2A
SCHEMBL8291368 0.75 MAPT (0.51) MAPTTDP1MEN1POLBKMT2A
SCHEMBL1065744 0.75 MAPT (0.42) MAPTTDP1MEN1POLBKMT2A
SCHEMBL8228999 0.73 MAPK1 (0.37) MAPTTDP1MEN1POLBKMT2A
SCHEMBL3973537 0.72 MAPT (0.69) MAPTTDP1MEN1POLBKMT2A
SCHEMBL13363663 0.71 GFER (0.46) MAPTTDP1TSHRALDH1A1RECQL
SCHEMBL8293247 0.70 MAPK1 (0.40) ARMAPTTDP1TSHRALDH1A1
SCHEMBL19733666 0.70 CYP3A4 (0.44) MAPTTDP1MEN1POLBKMT2A
SCHEMBL20788508 0.70 MAPT (0.56) MAPTTDP1MEN1POLBKMT2A
SCHEMBL2668038 0.69 TSHR (0.49) MAPTMEN1POLBKMT2ATSHR

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-2005030704-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2005-04-07 WO disclosed