SCHEMBL17803752

SCHEMBL17803752

CC(C)(C)[Si](OCc1cc(Cl)c(O)c(Cl)c1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
SLC16A3 O15427 5/20 0.33
SLC16A1 P53985 4/20 0.33
MCTS1 Q9ULC4 4/20 0.33
MAOB P27338 1/20 0.32
HSD17B13 Q7Z5P4 1/20 0.32
TTR P02766 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
DHODH Q02127 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
SCHEMBL2927140 0.86 PPARG (0.34) SMN1; SMN2KDM4E
SCHEMBL31124766 0.81 TSHR (0.35) SLC16A3TTRSMN1; SMN2
SCHEMBL16818604 0.81 TACR1 (0.34) SLC16A3SLC16A1MCTS1MEN1KMT2A
SCHEMBL9347235 0.80 ESR1 (0.43) TP53GAAMAPTMEN1KMT2A
SCHEMBL23070394 0.80 ALOX5AP (0.31) SLC16A3SLC16A1MCTS1
SCHEMBL17803751 0.80 NPC1 (0.32) MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL1314001 0.80 AGXT (0.42) MAPTMAOBSMN1; SMN2
SCHEMBL8149467 0.79 GABRA1 (0.41) MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL5672882 0.79 SMN1; SMN2 (0.35) TP53MAPTSLC16A3SLC16A1MCTS1
SCHEMBL5113620 0.78 MRGPRX4 (0.48) TP53MAPTMEN1KMT2ASMN1; 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
US-RE46024-E1 Thyroid hormone analogs HOFFMANN-LA ROCHE INC. (US) 2016-06-07 US disclosed