SCHEMBL25876280

SCHEMBL25876280

CCCn1ncc2c(O)nc(C3CCC(OC)(C(=O)OC)CC3)nc21

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 2/20 0.37
PDE1B Q01064 2/20 0.37
PDE1C Q14123 2/20 0.37
PDE4B Q07343 2/20 0.35
MAT2A P31153 2/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL25876239 0.92 MAT2A (0.32) MAT2AMEN1KMT2ASMN1; SMN2
SCHEMBL25875946 0.92 MAT2A (0.40) PDE4BMAT2AMEN1KMT2ASMN1; SMN2
SCHEMBL25876042 0.91 MAT2A (0.33) MAT2AMEN1KMT2ASMN1; SMN2
SCHEMBL25876275 0.89 PDE1A (0.36) PDE1APDE1BPDE1CPDE4BMAT2A
SCHEMBL25876083 0.88 MERTK (0.35) PDE1APDE1BPDE1CMAT2A
SCHEMBL25875917 0.87 PDE2A (0.40) PDE4BKMT2ASMN1; SMN2
SCHEMBL25876309 0.87 PIK3CA (0.36) MAT2A
SCHEMBL25876132 0.84 PIK3CA (0.34) PDE1BPDE1C
SCHEMBL25875905 0.83 KLKB1 (0.31)
SCHEMBL25875942 0.81 MAT2A (0.42) PDE4BMAT2A

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 PDE1A 491/4885PDE1B 397/4885PDE1C 798/4885

“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.