Glutaral

Glutaral

SCHEMBL8000996

CCC.O=CCCCC=O

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.77
TSHR P16473 4/20 0.69
ALDH1A1 P00352 3/20 0.56
FAAH O00519 2/20 0.52
TRPV1 Q8NER1 2/20 0.52
TDP1 Q9NUW8 2/20 0.47
MAPK1 P28482 1/20 0.47
MAPT P10636 1/20 0.44
ADH1B P00325 3/20 0.36
ADH1A P07327 3/20 0.36
ADH7 P40394 3/20 0.36
ADH1C P00326 2/20 0.36
EPHX1 P07099 1/20 0.35
ADH4 P08319 1/20 0.35

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 SCHEMBL1285455 0.88 HIF1A (1.00) HIF1ATSHRALDH1A1FAAHTRPV1
Glutaral SCHEMBL836 0.88
Glutaral SCHEMBL5969635 0.86 HIF1A (0.67) HIF1ATSHRALDH1A1FAAHTRPV1
Glutaral SCHEMBL6429549 0.86 ALDH1A1 (0.80) HIF1ATSHRALDH1A1FAAHTRPV1
Glutaral SCHEMBL20856845 0.86 ALDH1A1 (0.80) HIF1ATSHRALDH1A1FAAHTRPV1
Glutaral SCHEMBL27566525 0.85
Glutaral SCHEMBL7938260 0.85 HIF1A (0.77) HIF1ATSHRALDH1A1FAAHTRPV1
Glutaral SCHEMBL23631391 0.84
Glutaral SCHEMBL845792 0.84
Glutaral SCHEMBL6057369 0.84 HIF1A (0.91) HIF1ATSHRALDH1A1FAAHTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1011609-A4 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORP (US) 2000-08-16 EP disclosed
EP-1011609-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MedLogic Global Corporation (US) 2000-06-28 EP disclosed
WO-1998050005-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORPORATION (US) 1998-11-12 WO disclosed