SCHEMBL5524022

SCHEMBL5524022

CC(C)Cc1ccc(C(=O)O)c(C(=O)O)c1C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.38
LMNA P02545 5/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
HPGD P15428 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
CRHBP P24387 2/20 0.33
CRHR2 Q13324 2/20 0.33
MAPT P10636 2/20 0.33
AKR1C2 P52895 2/20 0.33
AKR1C1 Q04828 1/20 0.33
KMO O15229 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
HIF1A Q16665 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGS1 P23219 3/20 0.32

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
SCHEMBL5520152 0.86 ACMSD (0.41) ACMSDKMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL5518208 0.82 ACMSD (0.38) ACMSDKMT2AHTTSMN1; SMN2KMO
SCHEMBL1702164 0.80 CNR1 (0.38) ACMSD
SCHEMBL14989243 0.79 ACMSD (0.47) ACMSDKMT2AHTTSMN1; SMN2KMO
SCHEMBL5512339 0.79 ACMSD (0.40) ACMSDLMNAKMT2AALDH1A1HTT
SCHEMBL5524019 0.78 ACMSD (0.38) ACMSDKMOTSHRPTGDR2PTGDR
SCHEMBL5517633 0.77 ACMSD (0.37) ACMSDKMT2AHPGDHTTSMN1; SMN2
SCHEMBL5517327 0.77 ACMSD (0.43) ACMSDKMT2AHPGDALDH1A1HTT
SCHEMBL167431 0.75 ACMSD (0.44) ACMSDKMT2AHTTSMN1; SMN2KMO
SCHEMBL11409144 0.75 ACMSD (0.44) ACMSDKMT2AHTTSMN1; SMN2KMO

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-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed