SCHEMBL25816648

SCHEMBL25816648

O=C(C1CCNCC1)N1OCC[C@H]1c1cnccn1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.39
GSK3B P49841 3/20 0.39
RIPK1 Q13546 6/20 0.39
HRH3 Q9Y5N1 1/20 0.35
KARS1 Q15046 1/20 0.34
KCNK3 O14649 1/20 0.32
KDM4E B2RXH2 2/20 0.32
P2RY14 Q15391 1/20 0.31
SMYD3 Q9H7B4 1/20 0.31
PRCP P42785 1/20 0.31
CLK2 P49760 1/20 0.31
CLK3 P49761 1/20 0.31
WNT1 P04628 1/20 0.30
CYP46A1 Q9Y6A2 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL25258903 0.92 RIPK1 (0.37) DYRK1AGSK3BRIPK1HRH3
SCHEMBL31196458 0.85 RIPK1 (0.35) DYRK1AGSK3BRIPK1KCNK3KDM4E
SCHEMBL31205985 0.82 RIPK1 (0.39) DYRK1AGSK3BRIPK1HRH3SMYD3
SCHEMBL25259697 0.81 KDM4E (0.35) RIPK1KCNK3KDM4ESMYD3
SCHEMBL31205732 0.81 GSK3B (0.31) DYRK1AGSK3B
SCHEMBL31200021 0.80 RIPK1 (0.34) RIPK1KDM4E
SCHEMBL31199972 0.79 RIPK1 (0.38) DYRK1AGSK3BRIPK1KCNK3KDM4E
SCHEMBL31200061 0.78 RIPK1 (0.35) RIPK1
SCHEMBL25816590 0.78 RIPK1 (0.45) RIPK1HRH3SMYD3
SCHEMBL31205956 0.78 RIPK1 (0.53) RIPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK4, RIPK2 DYRK1A 1021/4885GSK3B 479/4885RIPK1 1/4885

“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.