SCHEMBL10068166

SCHEMBL10068166

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
GAA P10253 1/20 0.44
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
MAPK1 P28482 1/20 0.34
MAPK14 Q16539 1/20 0.34
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
FAAH O00519 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
SCHEMBL4405423 0.87 ALDH1A1 (0.48) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL10106480 0.82 ALDH1A1 (0.41) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL6682335 0.81 ALDH1A1 (0.44) ALDH1A1GAAMMP1MMP2MMP3
Hydrochloric Acid SCHEMBL11687442 0.79 ALDH1A1 (0.42) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL12016262 0.79 ALDH1A1 (0.42) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL11687438 0.79 ALDH1A1 (0.42) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL10106387 0.79 ALDH1A1 (0.39) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL11850265 0.79 ALDH1A1 (0.35) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL14817327 0.77 ALDH1A1 (0.41) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL27426652 0.77 ALDH1A1 (0.41) ALDH1A1GAAMMP1MMP2MMP3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097741-B2 Hybrid coatings prepared from glycidyl carbamate resins NDSU RESEARCH FOUNDATION (US) 2012-01-17 US disclosed