SCHEMBL8913271

SCHEMBL8913271

CCCCc1ccc(OC(=O)c2ccc(CCCCCC[Si]3(C)CCC(C)(C)O[Si]3(C)C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 4/20 0.39
THRA P10827 3/20 0.39
SPHK1 Q9NYA1 3/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
SPHK2 Q9NRA0 2/20 0.36
RARB P10826 4/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RARA P10276 1/20 0.35
MTOR P42345 1/20 0.35
KMT2A Q03164 1/20 0.35
PRSS1 P07477 1/20 0.35
ACR P10323 1/20 0.35
PLA2G4A P47712 2/20 0.35

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
SCHEMBL9303232 1.00 SMN1; SMN2 (0.41) SMN1; SMN2MAPTTHRBTHRASPHK1
SCHEMBL8913315 0.99 MAPT (0.41) SMN1; SMN2MAPTTHRBTHRASPHK1
SCHEMBL8913744 0.92 MAPT (0.39) SMN1; SMN2MAPTTHRBTHRANFKB1
SCHEMBL9304072 0.91 PRSS1 (0.43) SMN1; SMN2MAPTTHRBNFKB1NFKB2
SCHEMBL8914086 0.85 F2 (0.38) SMN1; SMN2MAPTLMNAMEN1ALDH1A1
SCHEMBL9511143 0.76 THRB (0.62) SMN1; SMN2MAPTTHRBTHRANFKB1
SCHEMBL28235899 0.76 THRB (0.62) SMN1; SMN2MAPTTHRBTHRANFKB1
SCHEMBL8021213 0.76 THRB (0.62) SMN1; SMN2MAPTTHRBTHRANFKB1
SCHEMBL8375690 0.75 THRB (0.64) SMN1; SMN2MAPTTHRBTHRANFKB1
SCHEMBL9016853 0.75 THRB (0.64) SMN1; SMN2MAPTTHRBTHRANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35462-E Silylated benzoic acid derivatives CONSORTIUM FUR ELEKOCHEMISCHE IND. GMBH (DE) 1997-02-25 US disclosed
US-5277838-A Silylated benzoic acid derivatives CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-01-11 US disclosed
US-5106530-A Liquid crystals Consortium Fur Elektrochemische Ind. (DE) 1992-04-21 US disclosed