SCHEMBL6686579

SCHEMBL6686579

CC(C)N(C(N)=O)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.37
LMNA P02545 2/20 0.35
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
ALDH1A1 P00352 2/20 0.31
OR51E2 Q9H255 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SLC7A5 Q01650 1/20 0.30
TP53 P04637 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30

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
SCHEMBL6686576 0.85 ALOX5 (0.34) ALOX5LMNAALOX15BLMPMP22
SCHEMBL3069002 0.83 ALOX5 (0.32) ALOX5
SCHEMBL27350443 0.79 ALOX5 (0.30) ALOX5
SCHEMBL29277007 0.78 ALOX5 (0.41) ALOX5LMNAALOX15BLMPMP22
SCHEMBL24065694 0.77 ALOX5 (0.33) ALOX5
SCHEMBL22693840 0.77 POLB (0.34) ALDH1A1
SCHEMBL22693822 0.77 TSHR (0.39) ALOX5LMNA
SCHEMBL24065718 0.75 ALOX5 (0.32) ALOX5
SCHEMBL20309418 0.75 ALOX5 (0.34) ALOX5LMNAALOX15BLMPMP22
SCHEMBL24065709 0.74 ALDH1A1 (0.36) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4

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
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed