SCHEMBL5813101

SCHEMBL5813101

CCOC(=O)C(CCO)NC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.47
CAD P27708 1/20 0.42
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
PTGS2 P35354 1/20 0.38
THPO P40225 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 2/20 0.38
PKM P14618 1/20 0.38
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL5813104 1.00 L3MBTL1 (0.50) L3MBTL1KMT2APOLBCADALDH1A1
SCHEMBL25961783 0.86 L3MBTL1 (0.51) L3MBTL1KMT2APOLBCADALDH1A1
SCHEMBL5807777 0.85 PLA2G2C (0.37) L3MBTL1KMT2APOLBALDH1A1KDM4E
SCHEMBL5807775 0.85 PLA2G2C (0.37) L3MBTL1KMT2APOLBALDH1A1KDM4E
SCHEMBL31146796 0.85 L3MBTL1 (0.50) L3MBTL1KMT2APOLBCADALDH1A1
SCHEMBL6001470 0.84 CAD (0.44) L3MBTL1KMT2APOLBCADALDH1A1
SCHEMBL6001474 0.84 CAD (0.44) L3MBTL1KMT2APOLBCADALDH1A1
SCHEMBL5812824 0.84 THRB (0.41) L3MBTL1ALDH1A1KDM4EMAPTTHRB
SCHEMBL5812827 0.84 THRB (0.41) L3MBTL1ALDH1A1KDM4EMAPTTHRB
SCHEMBL20053128 0.84 L3MBTL1 (0.58) L3MBTL1KMT2APOLBCADALDH1A1

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
WO-2006119283-A2 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J (US) 2006-11-09 WO claimed
US-20060251597-A1 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J 2006-11-09 US claimed
WO-2006119283-A2 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J (US) 2006-11-09 WO disclosed
US-20060251597-A1 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J 2006-11-09 US disclosed