SCHEMBL25876200

SCHEMBL25876200

Cc1cc(Nc2nc(Cl)nc3c2cnn3CC(C)(C)O)n[nH]1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 17/20 0.72
PAK4 O96013 6/20 0.64
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NTRK1 P04629 1/20 0.39
AURKA O14965 2/20 0.39
SYK P43405 1/20 0.39
AURKB Q96GD4 1/20 0.39
GSK3B P49841 1/20 0.39

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
SCHEMBL174987 0.85 PLK4 (0.55) PLK4PAK4MEN1HTTKMT2A
SCHEMBL26105438 0.84 PLK4 (1.00) PLK4PAK4NTRK1
SCHEMBL30297835 0.84 PLK4 (1.00) PLK4PAK4NTRK1
SCHEMBL174456 0.82 PLK4 (0.59) PLK4PAK4MEN1HTTKMT2A
SCHEMBL22054255 0.80 PLK4 (0.67) PLK4PAK4MEN1HTTKMT2A
SCHEMBL30297834 0.78 PLK4 (1.00) PLK4PAK4NTRK1
SCHEMBL26106093 0.78 PLK4 (1.00) PLK4PAK4NTRK1
SCHEMBL174354 0.78 PLK4 (0.50) PLK4PAK4NTRK1AURKA
SCHEMBL22054995 0.76 PLK4 (0.57) PLK4PAK4MEN1HTTKMT2A
SCHEMBL28978673 0.76 PLK4 (0.54) PLK4PAK4MEN1HTTKMT2A

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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 US disclosed
US-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 PLK4 1763/4885PAK4 143/4885MEN1 614/4885

“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.