SCHEMBL5810992

SCHEMBL5810992

CCOC(=O)[C@H](CCCCN)NC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.55
SIRT1 Q96EB6 1/20 0.55
CPB2 Q96IY4 2/20 0.51
TLR2 O60603 2/20 0.47
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
CYP1A2 P05177 1/20 0.42
CAD P27708 1/20 0.41
NOD1 Q9Y239 3/20 0.41
FOLH1 Q04609 1/20 0.41

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
SCHEMBL5810990 1.00 SIRT6 (0.55) SIRT6SIRT1CPB2TLR2KMT2A
SCHEMBL5814130 0.95 SIRT6 (0.49) SIRT6SIRT1CPB2TLR2KMT2A
SCHEMBL5814126 0.95 SIRT6 (0.49) SIRT6SIRT1CPB2TLR2KMT2A
SCHEMBL21879807 0.88 CPB2 (0.53) SIRT6SIRT1CPB2KMT2APOLB
SCHEMBL5808675 0.87 SIRT6 (0.56) SIRT6SIRT1CPB2TLR2CA1
SCHEMBL5808679 0.87 SIRT6 (0.56) SIRT6SIRT1CPB2TLR2CA1
SCHEMBL5494276 0.86 SIRT6 (0.54) SIRT6SIRT1TLR2CA1CA2
SCHEMBL2387748 0.86 SIRT6 (0.54) SIRT6SIRT1TLR2CA1CA2
Hydrochloric Acid SCHEMBL2122177 0.85 SIRT6 (0.52) SIRT6SIRT1TLR2CA1CA2
SCHEMBL21412801 0.85 SIRT6 (0.52) SIRT6SIRT1CPB2TLR2CA1

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