SCHEMBL12324725

SCHEMBL12324725

CCCC(=O)N[C@@H](C=O)CCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2C Q5R387 1/20 0.45
▸ HDAC3 O15379 2/20 0.42
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC2 Q92769 2/20 0.42
▸ HDAC8 Q9BY41 2/20 0.42
▸ PLA2G10 O15496 2/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ FFAR3 O14843 1/20 0.41
▸ CTSK P43235 9/20 0.41
▸ CTSD P07339 1/20 0.36
▸ FOLH1 Q04609 1/20 0.36
▸ RIMKLA Q8IXN7 1/20 0.36
▸ NAALAD2 Q9Y3Q0 1/20 0.36
▸ CTSL P07711 1/20 0.36
▸ CTSB P07858 1/20 0.36
▸ CTSH P09668 1/20 0.36
▸ PRSS1 P07477 1/20 0.36
▸ CTSG P08311 1/20 0.36
▸ CTRB1 P17538 1/20 0.36
▸ CMA1 P23946 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
SCHEMBL12324731 0.87 PLA2G2C (0.39) PLA2G2CPLA2G10CTSKFOLH1RIMKLA
SCHEMBL21686230 0.87 PLA2G2C (0.63) PLA2G2CPLA2G10
SCHEMBL29880335 0.87 PLA2G2C (0.63) PLA2G2CPLA2G10
SCHEMBL17793286 0.87 PLA2G2C (0.63) PLA2G2CPLA2G10
SCHEMBL9127074 0.87 PLA2G2C (0.63) PLA2G2CPLA2G10
SCHEMBL28227548 0.85 PLA2G2C (0.61) PLA2G2CPLA2G10
SCHEMBL21800920 0.85 PLA2G2C (0.61) PLA2G2CPLA2G10
SCHEMBL24486692 0.84 PLA2G2C (0.42) PLA2G2CPLA2G10CTSKFOLH1RIMKLA
SCHEMBL173035 0.84 PLA2G2C (0.42) PLA2G2CPLA2G10CTSKFOLH1RIMKLA
SCHEMBL17813082 0.83 PLA2G2C (0.46) PLA2G2CPLA2G10CTSK

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
WO-2011119759-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2011-09-29 — — WO disclosed
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