SCHEMBL21135341

SCHEMBL21135341

COC(=O)NCCOCCOCCN

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
EPHX1 P07099 1/20 0.42
HSP90AA1 P07900 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
TLR2 O60603 1/20 0.35
ACHE P22303 7/20 0.34
CA2 P00918 3/20 0.34
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA4 P22748 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 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
SCHEMBL9340071 0.87 EPHX1 (0.52) MEN1KMT2AEPHX1HSP90AA1SMN1; SMN2
SCHEMBL19172873 0.86 MEN1 (0.42) MEN1KMT2ASMN1; SMN2LMNATLR2
SCHEMBL12339214 0.84 ACHE (0.44) MEN1KMT2ASMN1; SMN2LMNAACHE
SCHEMBL4761785 0.84 ACHE (0.44) MEN1KMT2ASMN1; SMN2LMNAACHE
SCHEMBL14873875 0.83 EPHX1 (0.45) MEN1KMT2AEPHX1HSP90AA1SMN1; SMN2
SCHEMBL20696333 0.83 MEN1 (0.48) MEN1KMT2AEPHX1HSP90AA1SMN1; SMN2
SCHEMBL18850698 0.83 MEN1 (0.48) MEN1KMT2AEPHX1HSP90AA1SMN1; SMN2
SCHEMBL9587591 0.83 MEN1 (0.48) MEN1KMT2AEPHX1HSP90AA1SMN1; SMN2
SCHEMBL9980552 0.83 L3MBTL1 (0.43) MEN1KMT2ASMN1; SMN2LMNATLR2
SCHEMBL25209078 0.82 MEN1 (0.40) MEN1KMT2ASMN1; SMN2LMNATLR2

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-10336785-B2 Methods for synthesizing nucleotide analogues with disulfide linkers QIAGEN SCIENCES, LLC (US) 2019-07-02 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-10336785-B2 Methods for synthesizing nucleotide analogues with disulfide linkers RNGTT, NT5C3B, DUT MEN1 2635/4885KMT2A 2734/4885EPHX1 1312/4885

“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.