SCHEMBL1433255

SCHEMBL1433255

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

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.52
MASP2 O00187 3/20 0.52
MCHR1 Q99705 1/20 0.51
PYGL P06737 3/20 0.47
CTNNB1 P35222 2/20 0.45
CTSL P07711 3/20 0.44
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
MAPK14 Q16539 1/20 0.42
ALB P02768 1/20 0.42
IL2 P60568 1/20 0.42

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
SCHEMBL1434686 0.90 MCHR1 (0.55) F2MASP2MCHR1PYGLCTNNB1
SCHEMBL1433599 0.90 PYGL (0.50) F2MASP2PYGLCTNNB1ALB
SCHEMBL1433554 0.88 PYGL (0.52) F2PYGLCTNNB1CTSLCTSS
SCHEMBL1433128 0.87 MCHR1 (0.56) MCHR1PYGLCTNNB1CTSLCTSS
SCHEMBL1433141 0.86 MCHR1 (0.48) F2MASP2MCHR1PYGLCTSL
SCHEMBL1433111 0.85 F2 (0.53) F2MASP2CTSLMAPK14
SCHEMBL1433165 0.85 F2 (0.49) F2MCHR1PYGLCTNNB1ALB
SCHEMBL1433349 0.84 F2 (0.51) F2MASP2MCHR1PYGLCTNNB1
SCHEMBL1433514 0.81 CCKBR (0.57) CTSL
SCHEMBL3157965 0.80 F2 (0.60) F2MASP2

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