SCHEMBL29102724

SCHEMBL29102724

CCCCCC=CCCCCc1ccccc1OB(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
F7 P08709 3/20 0.47
F3 P13726 3/20 0.47
MMP2 P08253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
ECE1 P42892 1/20 0.47
SGMS1 Q86VZ5 1/20 0.47
SGMS2 Q8NHU3 1/20 0.47
MUS81 Q96NY9 1/20 0.47
HSD17B10 Q99714 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
ALOX5 P09917 1/20 0.46
PTGS2 P35354 1/20 0.46
BID P55957 3/20 0.44
BCL2L1 Q07817 3/20 0.44
MCL1 Q07820 3/20 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
SCHEMBL28506217 0.97 BID (0.47) LIPGTHRATHRBF7F3
SCHEMBL28799631 0.94 THRA (0.43) LIPGTHRATHRBF7F3
SCHEMBL28721125 0.93 LIPG (0.45) LIPGTHRATHRBF7F3
SCHEMBL4849451 0.91 LIPG (0.59) LIPGTHRATHRBSAE1ALOX5
SCHEMBL716479 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5
SCHEMBL4859494 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5
SCHEMBL4857505 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5
SCHEMBL4859387 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5
SCHEMBL4858367 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5
SCHEMBL4859267 0.90 LIPG (0.62) LIPGTHRATHRBSAE1ALOX5

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
CN-114207043-B Composition for producing siliceous film having low dielectric constant and method for producing cured film and electronic device using the same 默克专利有限公司 2023-09-15 CN disclosed