SCHEMBL1015946

SCHEMBL1015946

O=C(COCC(=O)Nc1ccc(Cl)cc1C(=O)O)Nc1cccc(-c2ccc(F)cc2)c1.[NaH]

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 6/20 0.54
CNR1 P21554 1/20 0.52
POLB P06746 1/20 0.52
G6PD P11413 1/20 0.52
GRIK1 P39086 2/20 0.49
MGLL Q99685 1/20 0.48
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
HCAR2 Q8TDS4 1/20 0.45
MAPT P10636 2/20 0.44

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
SCHEMBL1015100 0.99 SERPINE1 (0.55) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1015135 0.91 GRIK1 (0.51) SERPINE1POLBG6PDGRIK1KDM4E
SCHEMBL1015269 0.90 GRIK1 (0.52) SERPINE1POLBG6PDGRIK1KDM4E
SCHEMBL1015947 0.89 CNR1 (0.51) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1015837 0.89 CNR1 (0.51) SERPINE1CNR1POLBG6PDMGLL
SCHEMBL1015739 0.88 SERPINE1 (0.53) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1016298 0.88 SERPINE1 (0.54) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1014958 0.87 SERPINE1 (0.55) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1019407 0.87 SERPINE1 (0.54) SERPINE1CNR1POLBG6PDGRIK1
SCHEMBL1016300 0.86 SERPINE1 (0.54) SERPINE1CNR1POLBG6PDGRIK1

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-2990057-B1 PAI-1 INHIBITOR FOR USE IN ENHANCING THE ANTITUMOR EFFECT OF AN ANTITUMOR AGENT IN A PATIENT RENASCIENCE CO LTD (JP) 2019-03-20 EP disclosed
EP-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP disclosed