SCHEMBL1432545

SCHEMBL1432545

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.44
▸ MASP2 O00187 3/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ PDPK1 O15530 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL1431865 0.90 NAMPT (0.45) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1432011 0.90 NAMPT (0.45) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1904701 0.88 NAMPT (0.45) NAMPTMASP2MAPK1EHMT2L3MBTL1
SCHEMBL1432473 0.86 MASP2 (0.38) NAMPTMASP2NPSR1
SCHEMBL1904386 0.84 NAMPT (0.45) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1432449 0.83 NAMPT (0.43) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1432651 0.83 NAMPT (0.46) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1432133 0.83 MASP2 (0.40) NAMPTMASP2
SCHEMBL1432861 0.83 NAMPT (0.43) NAMPTMASP2EHMT2L3MBTL1KMT2A
SCHEMBL1901312 0.82 NAMPT (0.45) NAMPTMASP2EHMT2L3MBTL1KMT2A

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
Send feedback