SCHEMBL8725733

SCHEMBL8725733

CCCCCC(C=O)NC(=O)CO

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 17/20 0.51
CTSL P07711 5/20 0.42
CTSB P07858 5/20 0.42
CTSH P09668 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ASAH1 Q13510 2/20 0.40
DEGS1 O15121 1/20 0.39

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
SCHEMBL15060848 0.87 CTSK (0.53) CTSKCTSLCTSBCTSH
SCHEMBL13624945 0.87 CTSK (0.47) CTSKCTSLCTSBCTSH
SCHEMBL16478000 0.81 CTSK (0.54) CTSKCTSLCTSBCTSH
SCHEMBL27656524 0.79 FAAH (0.55) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL5879115 0.78 SLC6A5 (0.59) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL12446457 0.78 SLC6A5 (0.59) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL23505641 0.77 FAAH (0.58) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL27656564 0.77 FAAH (0.58) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL27656694 0.77 FAAH (0.58) CTSKMEN1KMT2AASAH1DEGS1
SCHEMBL23505651 0.77 FAAH (0.58) CTSKMEN1KMT2AASAH1DEGS1

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-0832898-A2 Substituted amino acid derivatives BAYER AG (DE) 1998-04-01 EP disclosed