SCHEMBL25819051

SCHEMBL25819051

CCC(=O)c1csc(C#N)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.38
RAB9A P51151 1/20 0.38
GSK3B P49841 2/20 0.37
DAO P14920 2/20 0.37
CA2 P00918 3/20 0.36
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ATM Q13315 1/20 0.33
IKBKB O14920 1/20 0.33
BRD4 O60885 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
PTGS1 P23219 1/20 0.32
DRD3 P35462 1/20 0.32
KMT2A Q03164 1/20 0.32
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL3973250 0.82 GSK3B (0.58) GSK3BDAOIKBKB
SCHEMBL26663876 0.77 DAO (0.50) DAOCA2MAPTSMN1; SMN2IKBKB
SCHEMBL10638896 0.76 DAO (0.35) GSK3BDAOIKBKB
SCHEMBL10511018 0.73 DAO (0.61) RAB9AGSK3BDAOCA2SMN1; SMN2
SCHEMBL25819048 0.72 GSK3B (0.40) RAB9AGSK3BDAOCA2MAPT
SCHEMBL10513627 0.72 DAO (0.59) GSK3BDAOCA2MAPTSMN1; SMN2
SCHEMBL21963268 0.68 CA2 (0.71) CA2
SCHEMBL12763640 0.67
SCHEMBL11382828 0.66 MAPT (0.50) MAPTSMN1; SMN2L3MBTL1ATMBRD4
SCHEMBL1146988 0.66 RAB9A (0.71) PGRRAB9AGSK3BCA2MAPT

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 3 patents. 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
CN-1117091-C Substd. isoxazolylthiophene compounds TAISHO PHARMACEUTICAL CO LTD (JP) 2003-08-06 CN disclosed
CN-1321156-A Substd. isoxazolylthiophene compounds TAISHO PHARMACEUTICAL CO LTD (JP) 2001-11-07 CN 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 PGR 4331/4885RAB9A 690/4885GSK3B 479/4885

“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.