SCHEMBL1433846

SCHEMBL1433846

Nc1ccc(CNC(=O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cc3ccccc3[nH]2)cn1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 2/20 0.49
▸ NAMPT P43490 1/20 0.47
▸ PYGL P06737 2/20 0.46
▸ ALB P02768 1/20 0.46
▸ IL2 P60568 1/20 0.46
▸ CTNNB1 P35222 2/20 0.44
▸ CTSL P07711 2/20 0.44
▸ CTSS P25774 2/20 0.44
▸ CTSK P43235 1/20 0.44

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
SCHEMBL1433787 0.94 MCHR1 (0.50) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1433480 0.93 MCHR1 (0.48) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1432911 0.90 MCHR1 (0.49) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1432730 0.88 MCHR1 (0.48) MCHR1NAMPTPYGLALBIL2
SCHEMBL1433228 0.86 PYGL (0.49) MCHR1NAMPTPYGLALBIL2
SCHEMBL1433942 0.86 CTNNB1 (0.54) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1432901 0.86 CTSL (0.55) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1433134 0.86 MCHR1 (0.47) MCHR1PYGLALBIL2CTNNB1
SCHEMBL1433128 0.86 MCHR1 (0.56) MCHR1NAMPTPYGLALBIL2
SCHEMBL1433000 0.85 MCHR1 (0.48) MCHR1NAMPTPYGLALBIL2

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
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