SCHEMBL420814

SCHEMBL420814

O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.66
THRB P10828 1/20 0.65
ALDH1A1 P00352 1/20 0.65
CYP1A2 P05177 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
POLB P06746 1/20 0.64
G6PD P11413 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.60
TP53 P04637 1/20 0.59
KMT2A Q03164 3/20 0.57
HCAR2 Q8TDS4 1/20 0.57
MEN1 O00255 2/20 0.57
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56

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
SCHEMBL419348 0.91 SERPINE1 (0.79) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL418985 0.91 THRB (0.72) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL420221 0.90 ALDH1A1 (0.68) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL417712 0.89 TP53 (0.64) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL418061 0.87 SERPINE1 (0.80) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL29838640 0.86 SERPINE1 (0.63) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL419002 0.86 SERPINE1 (0.63) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL5696427 0.84 HCAR2 (0.78) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL417809 0.83 HCAR2 (0.71) SERPINE1THRBALDH1A1CYP1A2CYP3A4
SCHEMBL4912964 0.83 NPC1 (0.80) THRBALDH1A1NPC1RAB9AL3MBTL1

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 10 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
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 (4 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 SERPINE1 1/4885THRB 2640/4885ALDH1A1 273/4885
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885THRB 3328/4885ALDH1A1 1450/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885THRB 3328/4885ALDH1A1 1450/4885
US-10092537-B2 Use for PAI-1 inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885THRB 2660/4885ALDH1A1 177/4885

“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.