Glutaral

Glutaral

SCHEMBL5734852

CCOC(C)OCC.CO.O=CCCCC=O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.44
HIF1A Q16665 1/20 0.43
TSHR P16473 2/20 0.42
TRPV1 Q8NER1 2/20 0.36
FAAH O00519 2/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.31

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
Glutaral SCHEMBL5733024 1.00 LMNA (0.52) LMNAMAPTHIF1ATSHRTRPV1
Glutaral SCHEMBL7174412 0.96 LMNA (0.57) LMNAMAPTHIF1ATSHRTRPV1
Glutaral SCHEMBL5733399 0.92 LMNA (0.48) LMNAMAPTHIF1ATSHRTRPV1
Glutaral SCHEMBL7886922 0.91 LMNA (0.52) LMNAMAPTHIF1ATSHRTRPV1
Glutaral SCHEMBL6229345 0.91 LMNA (0.52) LMNAMAPTHIF1ATSHRTRPV1
Pentanal SCHEMBL9295530 0.87 TSHR (0.61) LMNAMAPTHIF1ATSHRTRPV1
SCHEMBL11485155 0.86 LMNA (0.63) LMNAMAPTHIF1ATSHRTRPV1
Hexanal SCHEMBL10352184 0.85 TSHR (0.60) LMNAMAPTHIF1ATSHRTRPV1
Decanal SCHEMBL6949312 0.83 TSHR (0.64) LMNATSHRTRPV1FAAHALDH1A1
Heptanal SCHEMBL1664616 0.83 TSHR (0.64) LMNATSHRTRPV1FAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1244646-B1 DINITRILE INTERMEDIATES FOR THE SYNTHESIS OF OMAPATRILAT AND METHODS FOR PRODUCING SAME DIXIE CHEMICAL CO (US) 2006-08-23 EP disclosed
US-6300503-B1 Hydantoin intermediates for the synthesis of omapatrilat and methods for producing and using the same DIXIE CHEMICAL COMPANY 2001-10-09 US disclosed
US-6284901-B1 Dinitrile intermediates for the synthesis of omapatrilat and methods for producing same DIXIE CHEMICAL COMPANY 2001-09-04 US disclosed
WO-2001044202-A1 HYDANTOIN INTERMEDIATES FOR THE SYNTHESIS OF OMAPATRILAT AND METHODS FOR PRODUCING AND USING THE SAME DIXIE CHEMICAL COMPANY (US) 2001-06-21 WO disclosed