SCHEMBL25875942

SCHEMBL25875942

CCn1ncc2c(Cl)nc(C3CCC(OC)(C(=O)OC)CC3)nc21

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 9/20 0.42
LRRK2 Q5S007 6/20 0.36
PDE4B Q07343 2/20 0.35
PTGER3 P43115 1/20 0.34

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
SCHEMBL25876275 0.92 PDE1A (0.36) MAT2ALRRK2PDE4B
SCHEMBL25876077 0.90 MERTK (0.35) MAT2ALRRK2PDE4B
SCHEMBL25876233 0.90 MAT2A (0.33) MAT2ALRRK2PDE4B
SCHEMBL25876041 0.89 MAT2A (0.35) MAT2ALRRK2PDE4B
SCHEMBL25875946 0.89 MAT2A (0.40) MAT2APDE4B
SCHEMBL25875993 0.89 MAT2A (0.33) MAT2ALRRK2PDE4B
SCHEMBL25876299 0.89 LRRK2 (0.36) MAT2ALRRK2PDE4B
SCHEMBL25875863 0.87 PDE2A (0.41) PDE4B
SCHEMBL25876131 0.86 PDE9A (0.34)
SCHEMBL25875902 0.85 DGAT1 (0.33) MAT2APDE4B

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 MAT2A 686/4885LRRK2 181/4885PDE4B 586/4885

“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.