SCHEMBL10143384

SCHEMBL10143384

Cc1cc(=O)[nH]c2cc(NC(=O)[C@H](CCCCN)NC(=O)[C@@H]3CC4CCCCC4N3C(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 2/20 0.37
▸ HDAC3 O15379 6/20 0.35
▸ HDAC11 Q96DB2 6/20 0.35
▸ HDAC6 Q9UBN7 6/20 0.35
▸ HDAC1 Q13547 5/20 0.35
▸ HDAC2 Q92769 5/20 0.35
▸ HDAC10 Q969S8 5/20 0.35
▸ HDAC8 Q9BY41 5/20 0.35
▸ NTMT1 Q9BV86 2/20 0.35
▸ PLG P00747 2/20 0.35
▸ KLKB1 P03952 1/20 0.35
▸ FDFT1 P37268 1/20 0.33
▸ F11 P03951 1/20 0.33
▸ TPSAB1 Q15661 1/20 0.33
▸ HDAC4 P56524 1/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ MEF2D Q14814 1/20 0.32

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
SCHEMBL10143583 0.90 TLR2 (0.38) TLR2HDAC3HDAC11HDAC6HDAC1
SCHEMBL10144420 0.87 NTMT1 (0.45) TLR2HDAC3HDAC11HDAC6HDAC1
SCHEMBL10144446 0.83 TLR2 (0.43) TLR2PLGKLKB1TPSAB1HDAC4
SCHEMBL10144324 0.81 TLR2 (0.44) TLR2TPSAB1HDAC4EP300MEF2D
SCHEMBL10143499 0.80 TLR2 (0.45) TLR2TPSAB1HDAC4EP300MEF2D
SCHEMBL10143518 0.80 TLR2 (0.43) TLR2TPSAB1HDAC4EP300MEF2D
SCHEMBL10143502 0.79 TLR2 (0.45) TLR2TPSAB1HDAC4EP300MEF2D
SCHEMBL10144422 0.77 CA1 (0.39) TLR2HDAC3HDAC11HDAC6HDAC1
SCHEMBL10143401 0.76 TLR2 (0.46) TLR2HDAC3HDAC11HDAC6HDAC1
SCHEMBL10143497 0.76 TLR2 (0.42) TLR2HDAC1HDAC2TPSAB1

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
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