SCHEMBL18174546

SCHEMBL18174546

CNCCC(=O)NCCC(=O)NCCCCC(NC(=O)CCNC(=O)CCNC)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 3/20 0.49
▸ SIRT5 Q9NXA8 3/20 0.45
▸ TLR2 O60603 1/20 0.43
▸ NOD1 Q9Y239 3/20 0.42
▸ ROCK2 O75116 3/20 0.37
▸ PRKACA P17612 1/20 0.37
▸ AKT3 Q9Y243 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ FOLH1 Q04609 1/20 0.37
▸ CASP2 P42575 1/20 0.37
▸ GLP1R P43220 3/20 0.36
▸ SIRT2 Q8IXJ6 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
SCHEMBL24461841 1.00 ALB (0.49) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL24239462 0.92 ALB (0.44) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL21305215 0.92 ALB (0.44) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL12227120 0.91 NOD1 (0.44) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL14902998 0.88 CASP2 (0.51) ALBSIRT5TLR2NOD1EPHX2
SCHEMBL10027319 0.87 MEN1 (0.52) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL10130532 0.85 SIRT5 (0.60) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL10033607 0.85 ALB (0.45) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL14902999 0.84 GLP1R (0.46) ALBSIRT5TLR2NOD1ROCK2
SCHEMBL878812 0.82 SIRT5 (0.44) ALBSIRT5TLR2NOD1ROCK2

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-9475839-B2 Peptide-based inhibitor of interleukin-10 or interferon-gamma signaling THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2016-10-25 — — US disclosed
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