SCHEMBL5487181

SCHEMBL5487181

CCCCCCCOc1ccc([Si](OCC)(OCC)OCC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.56
LTA4H P09960 3/20 0.50
TP53 P04637 2/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 1/20 0.49
RARB P10826 3/20 0.46
NPC1 O15118 2/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL27822732 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL27822719 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL5484945 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL27841764 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL27822722 0.98 NR5A1 (0.53) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL14264672 0.95 CYP2D6 (0.54) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL28032455 0.84 NR5A1 (0.58) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL27822715 0.84 NR5A1 (0.58) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL5490733 0.82 NR5A1 (0.55) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL14226958 0.81 NQO1 (0.61) LTA4HTP53TSHRNPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7291747-B2 Silicon compounds and process for preparation thereof CHISSO CORPORATION (JP) 2007-11-06 US disclosed
US-20040143081-A1 Novel silicon compounds and process for preparation thereof JNC CORPORATION (JP) 2004-07-22 US disclosed