Glutarate

Glutarate

SCHEMBL28197350

CCCCC(=O)OCCC.O=C(O)CCCC(=O)O

nearest known ligand 0.68

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.59
PAM P19021 2/20 0.53
AKR1B1 P15121 1/20 0.52
TSHR P16473 5/20 0.52
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
PTPN1 P18031 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50

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
SCHEMBL19639 0.96 DGKA (0.57) DGKAPAMAKR1B1TSHRGPR84
SCHEMBL10550073 0.94 DGKA (0.55) DGKAPAMAKR1B1TSHRGPR84
Succinic Acid SCHEMBL28198007 0.94 DGKA (0.61) DGKAPAMAKR1B1TSHRGPR84
Hexanoate SCHEMBL7031339 0.92 DGKA (0.70) DGKAPAMAKR1B1TSHRGPR84
SCHEMBL1419216 0.92 DGKA (0.63) DGKAPAMAKR1B1TSHRGPR84
Decanoic Acid SCHEMBL25235181 0.90 DGKA (0.74) DGKAPAMAKR1B1TSHRGPR84
Heptanoate SCHEMBL28181115 0.90 DGKA (0.74) DGKAPAMAKR1B1TSHRGPR84
Undecanoate SCHEMBL28237356 0.90 DGKA (0.74) DGKAPAMAKR1B1TSHRGPR84
SCHEMBL29916 0.90 DGKA (0.61) DGKAPAMAKR1B1TSHRGPR84
SCHEMBL19939 0.90 DGKA (0.61) DGKAPAMAKR1B1TSHRGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107759460-A A kind of method for preparing the more acid monomers of polyphenyls 朱翠英 2018-03-06 CN disclosed
CN-107698445-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed
CN-107698436-A Method for preparing aromatic polycarboxylic acid derivative 朱翠英 2018-02-16 CN disclosed
CN-107698437-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed
CN-107698438-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed