SCHEMBL1432135

SCHEMBL1432135

CN(C)[C@H](Cc1ccccc1)C(=O)NC[C@H](C(=O)NCc1ccc(N)nc1)C1CCCC2CCCCC21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MASP2 O00187 3/20 0.39
▸ F2 P00734 2/20 0.34
▸ PRSS1 P07477 2/20 0.34
▸ PPIB P23284 1/20 0.34
▸ F10 P00742 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ CPB1 P15086 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MMP1 P03956 1/20 0.33
▸ FCER2 P06734 1/20 0.33
▸ KLKB1 P03952 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ F11 P03951 1/20 0.32

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
SCHEMBL1901133 0.89 MASP2 (0.39) MASP2F2PRSS1PPIBF10
SCHEMBL1432234 0.84 MASP2 (0.42) MASP2F2PRSS1PPIBF10
SCHEMBL1432321 0.84 MASP2 (0.38) MASP2F2PRSS1PPIBF10
SCHEMBL1431623 0.82 MASP2 (0.41) MASP2F2PRSS1PPIBF10
SCHEMBL1906629 0.82 HPGD (0.39) MASP2F2PRSS1ALDH1A1LMNA
SCHEMBL3141550 0.82 PSMB5 (0.43) MASP2F2PRSS1MMP1FCER2
SCHEMBL3141538 0.82 PSMB5 (0.43) MASP2F2PRSS1MMP1FCER2
SCHEMBL3141543 0.82 PSMB5 (0.43) MASP2F2PRSS1MMP1FCER2
SCHEMBL1432698 0.81 DPP4 (0.38) MASP2CPB1
SCHEMBL1901982 0.81 MASP2 (0.39) MASP2F2PRSS1PPIBF10

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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