SCHEMBL5086166

SCHEMBL5086166

C=C(CCNCCO)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TET2 Q6N021 4/20 0.32
TET3 O43151 1/20 0.32
TET1 Q8NFU7 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM2 Q14416 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL5086079 0.87 KDM4E (0.37) ALOX15HSD17B10KDM4EALDH1A1HTT
SCHEMBL629549 0.84 ALOX15 (0.37) ALOX15HSD17B10TET2TET3TET1
Itaconate SCHEMBL22204352 0.82 ALOX15 (0.56) ALOX15HSD17B10KDM4EALDH1A1HTT
Itaconate SCHEMBL5874896 0.82 ALOX15 (0.56) ALOX15HSD17B10KDM4EALDH1A1HTT
SCHEMBL636916 0.80 PAOX (0.41) ALOX15HSD17B10TET2TET3TET1
SCHEMBL22550973 0.79 ALOX15 (0.37) ALOX15HSD17B10KDM4EALDH1A1HTT
SCHEMBL819365 0.78 CAMK2A (0.36) ALOX15HSD17B10KDM4ETET2TET3
SCHEMBL636745 0.77 ALOX15 (0.35) ALOX15HSD17B10TET2TET3TET1
Diethanolamine SCHEMBL1834267 0.77 KDM4E (0.47) ALOX15KDM4EALDH1A1HTTSMN1; SMN2
Diethanolamine SCHEMBL1401642 0.77 KDM4E (0.47) ALOX15KDM4EALDH1A1HTTSMN1; SMN2

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-20080207797-A1 Anti-Fogging Coating Solution and Anti-Fogging Article SDC TECHNOLOGIES-ASIA LTD. (JP) 2008-08-28 US disclosed
US-4100225-A ANTISOILANT CIBA-GEIGY CORPORATION (US) 1978-07-11 US disclosed