SCHEMBL468852

SCHEMBL468852

CC(=O)N[C@@H](CCC(N)=O)C(=O)OC(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.38
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
ALDH1A1 P00352 2/20 0.37
BMP1 P13497 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ALOX15 P16050 2/20 0.34
BLM P54132 2/20 0.34
THRB P10828 1/20 0.34
NFKB1 P19838 1/20 0.34
PTGS2 P35354 1/20 0.34
THPO P40225 1/20 0.34

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
SCHEMBL468851 1.00 FOLH1 (0.38) FOLH1DPP4DPP8DPP9CHRM2
SCHEMBL468879 0.85 L3MBTL1 (0.42) FOLH1CHRM2CHRM4CHRM1ALDH1A1
SCHEMBL468880 0.85 L3MBTL1 (0.42) FOLH1CHRM2CHRM4CHRM1ALDH1A1
SCHEMBL19177135 0.84 FOLH1 (0.47) FOLH1DPP4DPP8DPP9CHRM2
SCHEMBL468916 0.84 FOLH1 (0.47) FOLH1DPP4DPP8DPP9CHRM2
SCHEMBL468918 0.84 FOLH1 (0.47) FOLH1DPP4DPP8DPP9CHRM2
SCHEMBL468835 0.83 ECE1 (0.40) FOLH1CHRM2CHRM4CHRM1ALDH1A1
SCHEMBL468837 0.83 ECE1 (0.40) FOLH1CHRM2CHRM4CHRM1ALDH1A1
SCHEMBL468758 0.81 L3MBTL1 (0.54) FOLH1CHRM2CHRM4CHRM1ALDH1A1
SCHEMBL468757 0.81 L3MBTL1 (0.54) FOLH1CHRM2CHRM4CHRM1ALDH1A1

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
US-RE42902-E1 N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use TRISTRATA, INC. (US) 2011-11-08 US 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