SCHEMBL4432859

SCHEMBL4432859

C=CC(=O)NN[C@@H](Cc1ccccc1)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.49
TACR1 P25103 1/20 0.46
ELANE P08246 1/20 0.46
HPRT1 P00492 1/20 0.46
TP53 P04637 2/20 0.45
POLB P06746 2/20 0.44
EGFR P00533 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TGM2 P21980 1/20 0.42
GSTO1 P78417 2/20 0.42
CTSL P07711 1/20 0.42
EPHX2 P34913 1/20 0.42
PPARG P37231 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 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
SCHEMBL1628974 0.86 TP53 (0.52) MMP8TACR1ELANETP53POLB
SCHEMBL9405476 0.86 TP53 (0.52) MMP8TACR1ELANETP53POLB
SCHEMBL25387266 0.83 MME (0.48) L3MBTL1ALDH1A1
SCHEMBL25387262 0.83 MME (0.48) L3MBTL1ALDH1A1
SCHEMBL2779606 0.79 MMP8 (0.55) MMP8TACR1ELANEHPRT1TP53
SCHEMBL7021893 0.77 MMP8 (0.56) MMP8TACR1ELANEHPRT1TP53
SCHEMBL7021895 0.77 MMP8 (0.56) MMP8TACR1ELANEHPRT1TP53
SCHEMBL4765072 0.77 MMP8 (0.59) MMP8TACR1ELANEHPRT1TP53
SCHEMBL8966036 0.77 MMP8 (0.59) MMP8TACR1ELANEHPRT1TP53
SCHEMBL27464748 0.77 MMP8 (0.59) MMP8TACR1ELANEHPRT1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578965-A4 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA PALL CORP (US) 2009-01-07 EP claimed
EP-1578965-A2 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA Pall Corporation (US) 2005-09-28 EP claimed
WO-2004060296-A2 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA PALL CORPORATION (US) 2004-07-22 WO claimed
US-20040127648-A1 Sorbent and method for the separation of plasmid DNA CIPHERGEN BIOSYSTEMS, INC. 2004-07-01 US claimed
EP-1578965-A4 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA PALL CORP (US) 2009-01-07 EP disclosed
EP-1578965-A2 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA Pall Corporation (US) 2005-09-28 EP disclosed
WO-2004060296-A2 SORBENT AND METHOD FOR THE SEPARATION OF PLASMID DNA PALL CORPORATION (US) 2004-07-22 WO disclosed
US-20040127648-A1 Sorbent and method for the separation of plasmid DNA CIPHERGEN BIOSYSTEMS, INC. 2004-07-01 US disclosed