SCHEMBL417037

SCHEMBL417037

COC(=O)c1cc(Cl)ccc1NC(=O)COc1cccc(C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.54
HIF1A Q16665 9/20 0.54
EPAS1 Q99814 6/20 0.54
MDH1 P40925 1/20 0.53
MDH2 P40926 1/20 0.53
EP300 Q09472 1/20 0.53
ALDH1A1 P00352 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 1/20 0.47
MAPK10 P53779 1/20 0.47
HSD17B10 Q99714 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
MAPK1 P28482 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL29896966 0.91 SERPINE1 (0.66) SERPINE1HIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL420870 0.91 SERPINE1 (0.66) SERPINE1HIF1AEPAS1ALDH1A1CYP1A2
SCHEMBL418072 0.90 HIF1A (0.66) SERPINE1HIF1AEPAS1MDH1MDH2
SCHEMBL421151 0.82 SERPINE1 (0.79) SERPINE1HIF1AEPAS1MDH1MDH2
SCHEMBL416752 0.80 HIF1A (0.74) SERPINE1HIF1AEPAS1MDH1MDH2
SCHEMBL418638 0.80 HIF1A (0.63) SERPINE1HIF1AEPAS1MDH1MDH2
SCHEMBL418741 0.79 ALDH1A1 (0.55) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL4297100 0.79 HIF1A (0.79) HIF1AEPAS1MDH1MDH2EP300
SCHEMBL416730 0.78 SERPINE1 (0.66) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL419319 0.77 ALDH1A1 (0.53) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2607348-B1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE INC (JP) 2021-03-17 EP disclosed
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO LTD (JP) 2014-10-02 US disclosed
US-8785473-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2014-07-22 US disclosed
EP-2607348-A2 Plasminogen Activator Inhibitor-1 Inhibitor Renascience CO., LTD. (JP) 2013-06-26 EP disclosed
EP-2415755-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Renascience CO., LTD. (JP) 2012-02-08 EP disclosed
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE CO., LTD. (JP) 2012-01-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885HIF1A 561/4885EPAS1 256/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885HIF1A 561/4885EPAS1 256/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.