SCHEMBL25816595

SCHEMBL25816595

N#Cc1ccc(/C=C/C=O)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
FGFR4 P22455 3/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
EGLN2 Q96KS0 1/20 0.33
CYP19A1 P11511 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP11B2 P19099 2/20 0.33
CYP11B1 P15538 1/20 0.33
FBP1 P09467 1/20 0.33
TRPA1 O75762 1/20 0.32
ALOX5 P09917 1/20 0.32
MAPK1 P28482 1/20 0.32
PDE10A Q9Y233 1/20 0.32
XDH P47989 1/20 0.32
GRM5 P41594 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL30547509 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EL3MBTL1FGFR4LMNA
SCHEMBL454403 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EL3MBTL1FGFR4LMNA
SCHEMBL286855 0.75 ALDH1A1 (0.42) ALDH1A1KDM4EL3MBTL1FGFR4LMNA
SCHEMBL24434470 0.73 ALDH1A1 (0.41) ALDH1A1KDM4EL3MBTL1LMNAGAA
SCHEMBL24434917 0.73 ALDH1A1 (0.41) ALDH1A1KDM4EL3MBTL1LMNAGAA
SCHEMBL628779 0.72 ALDH1A1 (0.54) ALDH1A1KDM4EL3MBTL1LMNAGAA
SCHEMBL1819167 0.72 ALDH1A1 (0.54) ALDH1A1KDM4EL3MBTL1LMNAGAA
SCHEMBL18921504 0.71 NFE2L2 (0.51) ALDH1A1L3MBTL1LMNATRPA1ALOX5
SCHEMBL18133615 0.71 CCR1 (0.43) ALDH1A1KDM4ELMNATRPA1ALOX5
SCHEMBL2555511 0.71 ALDH1A1 (0.39) ALDH1A1KDM4ELMNAMEN1KMT2A

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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 US disclosed
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 ALDH1A1 2211/4885KDM4E 2270/4885L3MBTL1 4764/4885

“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.