SCHEMBL26890665

SCHEMBL26890665

CC(C)(C)OC(=O)N1CCCn2nc(COS(C)(=O)=O)c(Cl)c2C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GRM5 P41594 1/20 0.36
▸ ESR2 Q92731 1/20 0.35
▸ CYBB P04839 1/20 0.35
▸ NOX5 Q96PH1 1/20 0.35
▸ NOX4 Q9NPH5 1/20 0.35
▸ NOX1 Q9Y5S8 1/20 0.35
▸ GPR119 Q8TDV5 10/20 0.34
▸ STS P08842 2/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ PREP P48147 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
SCHEMBL26890664 0.85 MEN1 (0.42) MEN1KMT2AGRM5ESR2CYBB
SCHEMBL25434759 0.84 STS (0.38) MEN1KMT2AGRM5ESR2GPR119
SCHEMBL25434099 0.81 MEN1 (0.40) MEN1KMT2AGRM5ESR2CYBB
SCHEMBL26686738 0.79 MEN1 (0.43) MEN1KMT2AESR2CYBBNOX5
SCHEMBL25335687 0.79 MEN1 (0.43) MEN1KMT2AESR2CYBBNOX5
SCHEMBL25337280 0.77 NR1H2 (0.42) MEN1KMT2AESR2CYBBNOX5
SCHEMBL26687047 0.77 ADORA1 (0.42) MEN1KMT2AESR2CYBBNOX5
SCHEMBL24535149 0.76 MEN1 (0.40) MEN1KMT2AESR2CYBBNOX5
SCHEMBL30793901 0.76 MEN1 (0.38) MEN1KMT2AESR2CYBBNOX5
SCHEMBL30793245 0.76 ESR2 (0.38) MEN1KMT2AGRM5ESR2GPR119

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-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 — — US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 — — 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 (2 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-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS MEN1 551/4885KMT2A 2868/4885GRM5 1619/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS MEN1 551/4885KMT2A 2868/4885GRM5 1619/4885

“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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