SCHEMBL21020138

SCHEMBL21020138

CCCCNC(=O)CCC(NC(=O)C(CC)CCCC)C(O)NCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 7/20 0.43
▸ CA1 P00915 5/20 0.43
▸ USP2 O75604 1/20 0.43
▸ CASP2 P42575 1/20 0.38
▸ MAPK1 P28482 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NAAA Q02083 1/20 0.36
▸ NOD1 Q9Y239 1/20 0.36
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP8 P22894 1/20 0.35
▸ MMP12 P39900 1/20 0.35
▸ MMP14 P50281 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35

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
SCHEMBL10066206 0.79 USP2 (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL24754576 0.79 USP2 (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL21020140 0.77 CA2 (0.45) CA2CA1USP2CASP2MAPK1
SCHEMBL21020133 0.77 GLP1R (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL21020147 0.76 CA1 (0.44) CA2CA1USP2CASP2NOD1
SCHEMBL21020203 0.73 USP2 (0.49) CA2CA1USP2MAPK1ALDH1A1
SCHEMBL5491789 0.73 USP2 (0.71) CA2CA1USP2MAPK1ALDH1A1
SCHEMBL11692574 0.71 USP2 (0.69) CA2CA1USP2MAPK1ALDH1A1
SCHEMBL23375897 0.69 CA2 (0.58) CA2CASP2ALDH1A1NAAANOD1
SCHEMBL29849120 0.69 USP2 (0.50) CA2CA1USP2MAPK1

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
EP-2658531-B1 USE OF GLUTAMIDE STABILIZERS AVON PROD INC (US) 2019-05-22 — — EP disclosed
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