SCHEMBL21020140

SCHEMBL21020140

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

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 6/20 0.45
▸ CA1 P00915 4/20 0.45
▸ USP2 O75604 1/20 0.45
▸ CTSK P43235 5/20 0.44
▸ CASP2 P42575 1/20 0.40
▸ CNR1 P21554 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ NAAA Q02083 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.37
▸ CASP3 P42574 1/20 0.36

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
SCHEMBL24754576 0.81 USP2 (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL10066206 0.81 USP2 (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL24115924 0.81 FAAH (0.54) CASP2CNR1MAPK1NAAANOD1
SCHEMBL21020133 0.79 GLP1R (0.50) CA2CA1USP2CASP2NOD1
SCHEMBL21020147 0.78 CA1 (0.44) CA2CA1USP2CASP2NOD1
SCHEMBL21020138 0.77 CA2 (0.43) CA2CA1USP2CASP2MAPK1
SCHEMBL12964825 0.76 NOD1 (0.56) CASP2CNR1NOD1
SCHEMBL13776558 0.76 CA2 (0.51) CA2CA1CTSKMAPK1CASP3
SCHEMBL5491789 0.75 USP2 (0.71) CA2CA1USP2MAPK1
SCHEMBL12295243 0.74 NOD1 (0.52) NOD1

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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