SCHEMBL1797244

SCHEMBL1797244

COC(=O)c1cc(-c2cccnc2)ccc1NC(=O)COCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.60
NPC1 O15118 1/20 0.48
NAMPT P43490 1/20 0.47
OPRD1 P41143 1/20 0.41
CACNA2D1 P54289 4/20 0.40
CACNA1B Q00975 4/20 0.40
CACNB1 Q02641 4/20 0.40
NR4A2 P43354 2/20 0.40
CYP3A4 P08684 2/20 0.40
USP2 O75604 1/20 0.40
CYP2D6 P10635 1/20 0.40
CACNA1C Q13936 3/20 0.39
CACNA1G O43497 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP3A5 P20815 1/20 0.39
MGLL Q99685 1/20 0.39

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
SCHEMBL1798252 0.93 SERPINE1 (0.70) SERPINE1NPC1NAMPTOPRD1CACNA2D1
SCHEMBL1798258 0.92 SERPINE1 (0.67) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1798068 0.91 SERPINE1 (0.62) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1796355 0.87 SERPINE1 (0.60) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1798072 0.87 SERPINE1 (0.60) SERPINE1NPC1NAMPTCACNA2D1CACNA1B
SCHEMBL1798420 0.87 SERPINE1 (0.63) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1797983 0.87 SERPINE1 (0.63) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1799737 0.85 SERPINE1 (0.61) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1799066 0.85 SERPINE1 (0.57) SERPINE1NPC1CACNA2D1CACNA1BCACNB1
SCHEMBL1799362 0.85 SERPINE1 (0.61) SERPINE1NPC1CACNA2D1CACNA1BCACNB1

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 2 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 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 (1 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-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885NPC1 1319/4885NAMPT 1948/4885

“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.