SCHEMBL416784

SCHEMBL416784

O=C(CC(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
HSD17B10 Q99714 1/20 0.56
GAA P10253 1/20 0.56
SERPINE1 P05121 5/20 0.54
NPSR1 Q6W5P4 2/20 0.54
HTT P42858 1/20 0.54
POLB P06746 1/20 0.54
G6PD P11413 1/20 0.54
BRD4 O60885 1/20 0.52
RECQL P46063 1/20 0.52
AKR1C4 P17516 1/20 0.51
AKR1C3 P42330 1/20 0.51
AKR1C2 P52895 1/20 0.51
AKR1C1 Q04828 1/20 0.51
TACR1 P25103 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL420909 0.87 NPSR1 (0.56) KDM4EGAANPSR1HTTPOLB
SCHEMBL418661 0.83 ALDH1A1 (0.59) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL416821 0.82 SERPINE1 (0.59) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL419300 0.81 KDM4E (0.60) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL1797078 0.80 SERPINE1 (0.63) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL27331760 0.79 KDM4E (0.66) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL418999 0.79 KDM4E (0.66) KDM4EHSD17B10GAASERPINE1POLB
SCHEMBL27794244 0.79 NPSR1 (0.53) KDM4ENPSR1HTTBRD4RECQL
SCHEMBL27794176 0.79 NPSR1 (0.47) KDM4ENPSR1HTTBRD4RECQL
SCHEMBL1797489 0.79 SERPINE1 (0.64) KDM4EHSD17B10GAASERPINE1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340665-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE RENASCIENCE INC. (JP) 2022-10-27 US disclosed
EP-4039276-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE Renascience Inc. (JP) 2022-08-10 EP disclosed
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-10092537-B2 Use for PAI-1 inhibitor RENASCIENCE CO., LTD. (JP) 2018-10-09 US disclosed
US-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2016-06-09 US disclosed
EP-2990057-A1 NOVEL USE FOR PAI-1 INHIBITOR Renascience Co., Ltd. (JP) 2016-03-02 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 (5 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-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 KDM4E 4253/4885HSD17B10 2766/4885GAA 849/4885
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 KDM4E 4490/4885HSD17B10 1809/4885GAA 812/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 KDM4E 4490/4885HSD17B10 1809/4885GAA 812/4885
US-20220340665-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE SERPINE1, CD274, PDCD1 KDM4E 2291/4885HSD17B10 3953/4885GAA 3672/4885
US-10092537-B2 Use for PAI-1 inhibitor SERPINE1, SERPINC1, SERPINB1 KDM4E 4348/4885HSD17B10 2794/4885GAA 846/4885

“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.