Glutarate

Glutarate

SCHEMBL6406301

C=Cc1ccccc1.O=C(O)CCCC(=O)O

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
TSHR P16473 1/20 0.58
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC10 Q969S8 2/20 0.50
HDAC11 Q96DB2 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HDAC9 Q9UKV0 2/20 0.50
HDAC5 Q9UQL6 2/20 0.50
MAPK1 P28482 1/20 0.50
ADRA1A P35348 1/20 0.50
SLC6A3 Q01959 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PPARA Q07869 1/20 0.49
MAPT P10636 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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
Styrene SCHEMBL5480221 0.91 ALDH1A1 (0.64) ALDH1A1TSHRHDAC3HDAC4HDAC1
Styrene SCHEMBL28590177 0.89 ALDH1A1 (0.61) ALDH1A1TSHRHDAC3HDAC4HDAC1
Styrene SCHEMBL2053184 0.87 AKR1B1 (0.55) ALDH1A1TSHRHDAC11PPARASLC22A6
Nonanoate SCHEMBL29876389 0.86 GPR84 (0.57) ALDH1A1TSHRHDAC11PPARAMAPT
Stearic Acid SCHEMBL8990596 0.86 GPR84 (0.57) ALDH1A1TSHRHDAC11PPARAMAPT
Octanoic Acid SCHEMBL2048076 0.86 GPR84 (0.57) ALDH1A1TSHRHDAC11PPARAMAPT
Stearic Acid SCHEMBL11405978 0.84 GPR84 (0.55) ALDH1A1TSHRHDAC11PPARAMAPT
Stearic Acid SCHEMBL11407656 0.84 GPR84 (0.55) ALDH1A1TSHRHDAC11PPARAMAPT
Styrene SCHEMBL7937843 0.84 ALDH1A1 (0.54) ALDH1A1TSHRHDAC3HDAC1HDAC2
Styrene SCHEMBL30629248 0.83 ALDH1A1 (0.44) ALDH1A1TSHRHDAC3HDAC4HDAC1

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-6923925-B2 Process of making poly (trimethylene dicarboxylate) fibers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2005-08-02 US disclosed
US-20040001950-A1 Poly(trimethylene dicarboxylate) fibers, their manufacture and use DUPONT INDUSTRIAL BIOSCIENCES USA, LLC 2004-01-01 US disclosed