SCHEMBL1797144

SCHEMBL1797144

Cc1sc(NC(=O)COCC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c(C(=O)O)c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.56
NPC1 O15118 1/20 0.54
GAA P10253 1/20 0.48
CACNA2D1 P54289 7/20 0.44
CACNA1B Q00975 7/20 0.44
CACNB1 Q02641 7/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.43
CACNA1C Q13936 6/20 0.43
LDHA P00338 1/20 0.43
CACNA1H O95180 1/20 0.43
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
USP2 O75604 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL17530216 0.99 SERPINE1 (0.56) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1794795 0.94 SERPINE1 (0.53) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1798992 0.92 SERPINE1 (0.52) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1796315 0.92 SERPINE1 (0.51) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1795271 0.90 SERPINE1 (0.50) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1798841 0.87 ALDH1A1 (0.52) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1802271 0.85 SERPINE1 (0.47) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1796499 0.83 SERPINE1 (0.45) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1800080 0.83 NPC1 (0.47) SERPINE1NPC1GAACACNA2D1CACNA1B
SCHEMBL1797219 0.82 ALDH1A1 (0.59) NPC1GAAALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951806-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2011-05-31 US claimed
US-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2009-05-14 US claimed
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-7951806-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2011-05-31 US disclosed
US-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2009-05-14 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-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885NPC1 2092/4885GAA 849/4885
US-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885NPC1 1319/4885GAA 721/4885
US-10092537-B2 Use for PAI-1 inhibitor SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885NPC1 1925/4885GAA 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.