SCHEMBL4827148

SCHEMBL4827148

O=C(O)c1cccc(C(=O)O)c1-c1ccccc1C1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
LMNA P02545 2/20 0.51
MAPT P10636 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
PTGS2 P35354 1/20 0.46
HNF4A P41235 1/20 0.45
KMO O15229 1/20 0.44
BRS3 P32247 1/20 0.44
MYC P01106 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ACMSD Q8TDX5 2/20 0.43
PTPN5 P54829 3/20 0.42
CAMKK1 Q8N5S9 2/20 0.42
CAMKK2 Q96RR4 2/20 0.42
PTPN2 P17706 1/20 0.42
GAA P10253 2/20 0.42

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
SCHEMBL8774864 0.89 PTGDR2 (0.48) ALDH1A1LMNAMAPTL3MBTL1PTGDR2
SCHEMBL10951907 0.85 PTGDR2 (0.43) ALDH1A1LMNAMAPTPTGDR2PTGS2
SCHEMBL50486 0.84 PTGDR2 (0.53) ALDH1A1PTGDR2KMOACMSDCAMKK1
SCHEMBL30730923 0.84 PTGDR2 (0.53) ALDH1A1PTGDR2KMOACMSDCAMKK1
SCHEMBL29029016 0.84 FOLH1 (0.46) ALDH1A1LMNAMAPTL3MBTL1PTGDR2
SCHEMBL8774870 0.84 PTGDR2 (0.47) ALDH1A1LMNAMAPTPTGDR2HNF4A
Ammonia Solution, Strong SCHEMBL29036685 0.83 PTGDR2 (0.51) ALDH1A1PTGDR2KMOACMSDCAMKK1
SCHEMBL10634854 0.83 KDM4E (0.53) ALDH1A1LMNAMAPTL3MBTL1PTGDR2
SCHEMBL10634926 0.83 KDM4E (0.53) ALDH1A1LMNAMAPTL3MBTL1PTGDR2
SCHEMBL2731512 0.83 ALDH1A1 (0.50) ALDH1A1LMNAMAPTPTGDR2KMO

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-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US disclosed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US disclosed