SCHEMBL1013771

SCHEMBL1013771

O=C(COCC(=O)N(C1CCCCC1)C1CCCCC1)Nc1ccc(Cl)cc1C(=O)O.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 5/20 0.49
POLB P06746 2/20 0.48
G6PD P11413 1/20 0.48
KDM4E B2RXH2 3/20 0.45
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 1/20 0.43
ABCC1 P33527 1/20 0.43
KCNJ6 P48051 1/20 0.41
KCNJ3 P48549 1/20 0.41
TSHR P16473 1/20 0.41
PYGL P06737 1/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL1015397 0.99 SERPINE1 (0.50) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1013772 0.90 KMT2A (0.44) SERPINE1POLBG6PDKDM4EMEN1
SCHEMBL1013555 0.89 KMT2A (0.48) POLBKDM4EHSD17B10MEN1KMT2A
SCHEMBL1015239 0.87 SERPINE1 (0.50) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1014856 0.86 SERPINE1 (0.51) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1015522 0.83 RAB9A (0.55) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1012592 0.80 SERPINE1 (0.64) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1015240 0.80 MEN1 (0.46) SERPINE1POLBG6PDKDM4EMEN1
SCHEMBL1015276 0.79 SERPINE1 (0.65) SERPINE1POLBG6PDKDM4EHSD17B10
SCHEMBL1797141 0.78 SERPINE1 (0.55) SERPINE1POLBG6PDKDM4EHSD17B10

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 3 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-2990057-A1 NOVEL USE FOR PAI-1 INHIBITOR Renascience Co., Ltd. (JP) 2016-03-02 EP disclosed
EP-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP disclosed