SCHEMBL20705255

SCHEMBL20705255

CNC(=O)C(CCCCNC(C)=O)NC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.52
SIRT5 Q9NXA8 3/20 0.48
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
SIRT1 Q96EB6 3/20 0.47
SIRT6 Q8N6T7 1/20 0.47
ADRA1A P35348 1/20 0.43
PAOX Q6QHF9 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
ALB P02768 2/20 0.36
BMP1 P13497 1/20 0.36
MMP1 P03956 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36

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
SCHEMBL21303704 0.90 SIRT1 (0.56) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL4567600 0.90 SIRT1 (0.56) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL19115851 0.90 SIRT1 (0.42) FOLH1SIRT5SIRT1SIRT6BMP1
SCHEMBL20705261 0.86 SIRT1 (0.43) FOLH1SIRT5SIRT1SIRT6BMP1
SCHEMBL15218260 0.85 KDM4E (0.52) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL20411663 0.85 KDM4E (0.52) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL18117452 0.85 KDM4E (0.52) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL19057917 0.83 KDM4E (0.55) FOLH1SIRT5KDM4EMAPK1HIF1A
SCHEMBL8163264 0.80 CTSK (0.51) FOLH1SIRT5MMP1MMP3
SCHEMBL19057918 0.80 KDM4E (0.48) FOLH1SIRT5KDM4EMAPK1HIF1A

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-20240199602-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-20 US disclosed
US-11905285-B2 Inhibitors of plasma kallikrein and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-20 US disclosed
US-20220056028-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-02-24 US disclosed
US-11168083-B2 Inhibitors of Plasma Kallikrein and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-09 US disclosed
US-20200239463-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF DYAX CORP. (US) 2020-07-30 US disclosed
EP-3661922-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF Dyax Corp. (US) 2020-06-10 EP disclosed
WO-2019028362-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF DYAX CORP. (US) 2019-02-07 WO 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 (5 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-20240199602-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF KLKB1, KLK1, KLK5 FOLH1 2042/4885SIRT5 1627/4885KDM4E 1766/4885
US-11168083-B2 Inhibitors of Plasma Kallikrein and uses thereof KLKB1, KLK1, KLK5 FOLH1 2042/4885SIRT5 1627/4885KDM4E 1766/4885
US-20200239463-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF KLKB1, KLK1, KLK5 FOLH1 2042/4885SIRT5 1627/4885KDM4E 1766/4885
US-20220056028-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF KLKB1, KLK1, KLK5 FOLH1 2042/4885SIRT5 1627/4885KDM4E 1766/4885
US-11905285-B2 Inhibitors of plasma kallikrein and uses thereof KLKB1, KLK1, KLK5 FOLH1 2042/4885SIRT5 1627/4885KDM4E 1766/4885

“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.