SCHEMBL3407463

SCHEMBL3407463

O=C1CCCCCCCCCCCCCCCCCC/C=C/1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.39
GSTP1 P09211 2/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
PRKCI P41743 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B1 P14061 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL11130669 1.00 HIF1A (0.39) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL18198956 1.00 HIF1A (0.39) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL6055699 1.00 HIF1A (0.39) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL3404238 1.00 HIF1A (0.39) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL15133421 0.98
SCHEMBL1031855 0.90
SCHEMBL1006026 0.79
SCHEMBL277115 0.72 GSTP1 (0.37) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL6244929 0.71 GSTP1 (0.38) HIF1AGSTP1HDAC4HDAC2HDAC8
SCHEMBL354995 0.71 GSTP1 (0.38) HIF1AGSTP1HDAC4HDAC2HDAC8

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
EP-2254546-A2 TOPICAL COMPOSITIONS AND METHODS FOR WHITENING SKIN ELC Management LLC (US) 2010-12-01 EP disclosed
WO-2009105294-A2 TOPICAL COMPOSITIONS AND METHODS FOR WHITENING SKIN ELC MANAGEMENT LLC (US) 2009-08-27 WO disclosed