SCHEMBL1432618

SCHEMBL1432618

CCCN(C)[C@@H](C)C(=O)NC[C@H](C(=O)NCc1ccc(N)nc1)c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.41
▸ MASP2 O00187 3/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ EHMT2 Q96KQ7 1/20 0.35
▸ TACR1 P25103 1/20 0.35
▸ CCR2 P41597 1/20 0.35

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
SCHEMBL1432369 0.90 MASP2 (0.38) NAMPTMASP2KMT2AMEN1
SCHEMBL1432651 0.88 NAMPT (0.46) NAMPTMASP2KMT2AL3MBTL1EHMT2
SCHEMBL1432449 0.88 NAMPT (0.43) NAMPTMASP2KMT2AL3MBTL1EHMT2
SCHEMBL1431865 0.83 NAMPT (0.45) NAMPTMASP2KMT2AMEN1L3MBTL1
SCHEMBL1904701 0.83 NAMPT (0.45) NAMPTMASP2L3MBTL1EHMT2
SCHEMBL1904386 0.83 NAMPT (0.45) NAMPTMASP2KMT2AMEN1L3MBTL1
SCHEMBL1432011 0.83 NAMPT (0.45) NAMPTMASP2KMT2AMEN1L3MBTL1
SCHEMBL3153185 0.83 NAMPT (0.42) NAMPTMASP2KMT2AMEN1
SCHEMBL1432614 0.83 NAMPT (0.42) NAMPTMASP2KMT2AMEN1
SCHEMBL1432861 0.81 NAMPT (0.43) NAMPTMASP2KMT2AMEN1L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 — — WO disclosed
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