SCHEMBL1019736

SCHEMBL1019736

NC(CO)(CO)COC(=O)c1cc(Cl)ccc1NC(=O)COCC(=O)Nc1cccc(-c2ccoc2)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 6/20 0.56
CNR1 P21554 1/20 0.46
MAPT P10636 4/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.36
XBP1 P17861 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KLK7 P49862 1/20 0.36
TSHR P16473 1/20 0.34

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
Tromethamine SCHEMBL1019735 0.89 SERPINE1 (0.68) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL1015662 0.85 SERPINE1 (0.64) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL1016107 0.84 SERPINE1 (0.77) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL29492572 0.84 SERPINE1 (0.77) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL22468222 0.83 SERPINE1 (0.75) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL29448187 0.82 SERPINE1 (0.64) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL20814654 0.79 SERPINE1 (0.53) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL1016292 0.79 SERPINE1 (0.61) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL1012933 0.77 SERPINE1 (0.61) SERPINE1CNR1MAPTKMT2AMEN1
SCHEMBL1012706 0.76 SERPINE1 (0.80) SERPINE1CNR1KMT2AMEN1ALDH1A1

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-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP disclosed