SCHEMBL13416254

SCHEMBL13416254

NC(CO)C(=O)NCCOCCON(O)O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CA2 P00918 7/20 0.42
▸ TLR2 O60603 9/20 0.34
▸ DPP7 Q9UHL4 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL13416457 0.86 MEN1 (0.44) MEN1KMT2ACA2TLR2DPP7
SCHEMBL14135506 0.85 MEN1 (0.42) MEN1KMT2ACA2TLR2SMN1; SMN2
SCHEMBL13416236 0.83 DPP7 (0.42) TLR2DPP7
SCHEMBL14135433 0.81 GNAI3 (0.51) MEN1KMT2ACA2TLR2DPP7
SCHEMBL13416268 0.81 RRM1 (0.42) TLR2DPP7
SCHEMBL13416086 0.80 CTSC (0.43) MEN1KMT2ACA2TLR2DPP7
SCHEMBL13416283 0.79 MEN1 (0.54) MEN1KMT2ACA2TLR2SMN1; SMN2
SCHEMBL13416746 0.78 DPP7 (0.40) MEN1KMT2ACA2TLR2DPP7
SCHEMBL13416245 0.77 ALDH1A1 (0.31) —
SCHEMBL14135391 0.76 GLP1R (0.40) MEN1KMT2ATLR2DPP7

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-20100099729-A1 NITRIC OXIDE DONOR COMPOUNDS NICOX S.A. (FR) 2010-04-22 — — US disclosed
WO-2008095841-A2 NITRIC OXIDE DONOR COMPOUNDS NICOX S.A. (FR) 2008-08-14 — — WO 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-20100099729-A1 NITRIC OXIDE DONOR COMPOUNDS NOS3, NOS2, NOS1 MEN1 615/4885KMT2A 4459/4885CA2 2652/4885

“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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