SCHEMBL1433554

SCHEMBL1433554

Cc1nc(N)ccc1CNC(=O)[C@@H](Cc1cccc(Cl)c1)NC(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PYGL P06737 7/20 0.52
F2 P00734 1/20 0.51
CTNNB1 P35222 3/20 0.49
CTSV O60911 6/20 0.46
CTSL P07711 6/20 0.46
CTSS P25774 6/20 0.46
CTSK P43235 5/20 0.46
CTSB P07858 3/20 0.46

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
SCHEMBL1433599 0.92 PYGL (0.50) PYGLF2CTNNB1CTSB
SCHEMBL1433165 0.90 F2 (0.49) PYGLF2CTNNB1
SCHEMBL1434012 0.89 PYGL (0.52) PYGLF2CTNNB1CTSLCTSS
SCHEMBL1433255 0.88 F2 (0.52) PYGLF2CTNNB1CTSLCTSS
SCHEMBL1433942 0.86 CTNNB1 (0.54) PYGLCTNNB1CTSVCTSLCTSS
SCHEMBL1433349 0.86 F2 (0.51) PYGLF2CTNNB1CTSLCTSS
SCHEMBL1434232 0.84 F2 (0.51) F2CTSVCTSLCTSSCTSK
SCHEMBL1433514 0.83 CCKBR (0.57) CTSL
SCHEMBL1433141 0.82 MCHR1 (0.48) PYGLF2CTSLCTSSCTSK
SCHEMBL1433228 0.79 PYGL (0.49) PYGLCTNNB1CTSLCTSSCTSK

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-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 EP disclosed