SCHEMBL8913315

SCHEMBL8913315

CCCCc1ccc(OC(=O)c2ccc(CCCC[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
MAPT P10636 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
THRB P10828 5/20 0.39
THRA P10827 2/20 0.38
PRSS1 P07477 1/20 0.35
ACR P10323 1/20 0.35
NPC1 O15118 2/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SPHK1 Q9NYA1 2/20 0.35
RARB P10826 1/20 0.34
PLK1 P53350 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
KMT2A Q03164 1/20 0.34

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 0.99 SMN1; SMN2 (0.41) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL8913271 0.99 SMN1; SMN2 (0.41) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL8913744 0.93 MAPT (0.39) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9304072 0.92 PRSS1 (0.43) MAPTSMN1; SMN2THRBPRSS1ACR
SCHEMBL8914086 0.86 F2 (0.38) MAPTSMN1; SMN2PRSS1ACRLMNA
SCHEMBL5665862 0.75 THRB (0.63) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL5666123 0.75 THRB (0.63) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL7210214 0.75 THRB (0.58) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL7951967 0.75 THRB (0.58) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL778221 0.75 THRB (0.58) MAPTSMN1; SMN2THRBTHRAPRSS1

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