SCHEMBL418089

SCHEMBL418089

COC(=O)c1cc(Cl)ccc1NC(=O)Cn1ccc2cc(Br)ccc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NTSR1 P30989 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
KRAS P01116 6/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
BLM P54132 1/20 0.47
ALDH1A1 P00352 3/20 0.45
GAA P10253 2/20 0.45
HSD17B10 Q99714 1/20 0.45
NPY5R Q15761 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL417918 0.88 MEN1 (0.53) NTSR1KRASPOLBGAAHSD17B10
SCHEMBL415966 0.85 MAPT (0.54) NTSR1RXFP1MAPTPOLBALDH1A1
SCHEMBL420313 0.76 MAPT (0.58) RXFP1MAPTALDH1A1GAAHSD17B10
SCHEMBL15712688 0.75 EGFR (0.43) MAPTPOLBMEN1KMT2ALMNA
SCHEMBL4737108 0.75 POLB (0.59) MAPTPOLBBLMALDH1A1GAA
SCHEMBL21810428 0.74 NTSR1 (0.57) NTSR1KRAS
SCHEMBL30556513 0.74 RXFP1 (0.53) RXFP1MAPTPOLBBLMALDH1A1
SCHEMBL420811 0.74 SERPINE1 (0.55) NTSR1MAPTPOLBALDH1A1GAA
SCHEMBL1015320 0.73 ALDH1A1 (0.57) RXFP1MAPTPOLBALDH1A1GAA
SCHEMBL417874 0.73 RXFP1 (0.54) RXFP1ALDH1A1GAAHSD17B10MEN1

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 NTSR1 2295/4885RXFP1 947/4885KRAS 4082/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 NTSR1 2295/4885RXFP1 947/4885KRAS 4082/4885

“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.