SCHEMBL417046

SCHEMBL417046

COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1CCCN1C(=O)Cc1cccc(-c2ccoc2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 5/20 0.47
ALDH1A1 P00352 1/20 0.41
F2 P00734 2/20 0.40
OPRK1 P41145 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.39
EP300 Q09472 1/20 0.38
CREBBP Q92793 1/20 0.38
TACR1 P25103 1/20 0.38
GFER P55789 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL417045 1.00 SERPINE1 (0.47) SERPINE1ALDH1A1F2OPRK1NPSR1
SCHEMBL419504 0.91 SERPINE1 (0.58) SERPINE1ALDH1A1F2NPSR1GFER
SCHEMBL419505 0.91 SERPINE1 (0.58) SERPINE1ALDH1A1F2NPSR1GFER
SCHEMBL415948 0.87 RHOA (0.47) SERPINE1ALDH1A1
SCHEMBL415913 0.87 SERPINE1 (0.51) SERPINE1EP300CREBBP
SCHEMBL415912 0.87 SERPINE1 (0.51) SERPINE1EP300CREBBP
SCHEMBL27851493 0.86 CNR1 (0.50) SERPINE1ALDH1A1F2MEN1KMT2A
SCHEMBL418556 0.81 SERPINE1 (0.61) SERPINE1ALDH1A1MEN1KMT2A
SCHEMBL29838654 0.78 SERPINE1 (0.57) SERPINE1ALDH1A1
SCHEMBL420156 0.78 SERPINE1 (0.57) SERPINE1ALDH1A1

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 1/4885ALDH1A1 1450/4885F2 24/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885ALDH1A1 1450/4885F2 24/4885

“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.