SCHEMBL25603074

SCHEMBL25603074

CCC(C)(C)C(=O)CCOCCN1C(=O)C=CC1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 8/20 0.54
▸ GSK3A P49840 2/20 0.41
▸ GSK3B P49841 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.38
▸ BLM P54132 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ WRN Q14191 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ PTGS1 P23219 7/20 0.37
▸ PTGS2 P35354 7/20 0.37
▸ FAAH O00519 4/20 0.37
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ GMNN O75496 1/20 0.35
▸ THPO P40225 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ HSP90AA1 P07900 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
SCHEMBL24234412 0.99 MGLL (0.57) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL18350691 0.86 MGLL (0.59) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL23191526 0.85 MGLL (0.62) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL24637629 0.81 MGLL (0.49) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL25113065 0.79 PTGS1 (0.58) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL12330964 0.79 PTGS1 (0.58) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL17480214 0.78 MGLL (0.66) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL18089311 0.78 MGLL (0.56) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL26422942 0.78 MGLL (0.56) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL22601885 0.77 MGLL (0.65) MGLLGSK3AGSK3BALDH1A1BLM

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172910-A1 ANTIBODY DRUG CONJUGATES COMPRISING STING AGONISTS MERSANA THERAPEUTICS, INC. 2023-06-08 — — 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-20230172910-A1 ANTIBODY DRUG CONJUGATES COMPRISING STING AGONISTS STING1, CGAS, IFNAR1 MGLL 3010/4885GSK3A 2428/4885GSK3B 2541/4885

“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.

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