SCHEMBL6913308

SCHEMBL6913308

C=C(CCCCC[Si](OCC)(OCC)OCC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.39
THRB P10828 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
GAA P10253 1/20 0.32
GPR84 Q9NQS5 7/20 0.31
PPARG P37231 7/20 0.31
PPARD Q03181 7/20 0.31
PPARA Q07869 7/20 0.31
HDAC11 Q96DB2 5/20 0.31
TSHR P16473 4/20 0.31
PTPN1 P18031 3/20 0.31
ALDH1A1 P00352 2/20 0.31
TLR2 O60603 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
FABP4 P15090 2/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
MEN1 O00255 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
SCHEMBL6917574 1.00 TBXAS1 (0.39) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL6917061 1.00 TBXAS1 (0.39) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL291058 0.98 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
Hydrogen Sulfide SCHEMBL379805 0.97 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL1692104 0.93 TBXAS1 (0.34) TBXAS1
SCHEMBL6908559 0.92 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL6915317 0.92 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL6914001 0.92 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL6915871 0.92 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B
SCHEMBL6918154 0.92 TBXAS1 (0.36) TBXAS1THRBFNTAFNTBPGGT1B

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
EP-1360245-B1 ADHESIVES FOR METAL-POLYMER COMPOSITES 3M ESPE AG (DE) 2004-07-14 EP disclosed
EP-1360245-A1 ADHESIVES FOR METAL-POLYMER COMPOSITES 3M Espe AG (DE) 2003-11-12 EP disclosed
WO-2002072711-A1 ADHESIVES FOR METAL-POLYMER COMPOSITES 3M ESPE AG (DE) 2002-09-19 WO disclosed