SCHEMBL420616

SCHEMBL420616

O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 11/20 1.00
MAPT P10636 2/20 0.71
AKR1C4 P17516 1/20 0.71
AKR1C3 P42330 1/20 0.71
AKR1C2 P52895 1/20 0.71
AKR1C1 Q04828 1/20 0.71
ALDH1A1 P00352 1/20 0.65
LMNA P02545 1/20 0.65
CA2 P00918 2/20 0.64
CA9 Q16790 2/20 0.64
CA12 O43570 1/20 0.64
CA1 P00915 1/20 0.64
CA7 P43166 1/20 0.64
KCNK2 O95069 1/20 0.63
KCNK10 P57789 1/20 0.63
TP53 P04637 1/20 0.62

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
SCHEMBL6358123 0.94 SERPINE1 (0.89) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL6351321 0.94 SERPINE1 (0.89) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL6349319 0.92 SERPINE1 (0.85) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL6351306 0.91 SERPINE1 (0.82) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL11571840 0.90 MAPT (0.86) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL421010 0.89 SERPINE1 (1.00) SERPINE1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL6352878 0.87 SERPINE1 (0.76) SERPINE1MAPTAKR1C4AKR1C3AKR1C2
SCHEMBL6351589 0.85 KMT2A (0.75) SERPINE1MAPTALDH1A1LMNAKCNK2
SCHEMBL6353639 0.85 SERPINE1 (0.74) SERPINE1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL6349535 0.85 SERPINE1 (0.74) SERPINE1AKR1C4AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415755-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Renascience CO., LTD. (JP) 2012-02-08 EP claimed
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE CO., LTD. (JP) 2012-01-26 US claimed
US-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed
WO-2004018414-A2 ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO claimed
EP-2607348-B1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE INC (JP) 2021-03-17 EP disclosed
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
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 (3 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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 SERPINE1 1929/4885MAPT 4753/4885AKR1C4 3065/4885
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885MAPT 2976/4885AKR1C4 744/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885MAPT 2976/4885AKR1C4 744/4885

“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.