SCHEMBL7033775

SCHEMBL7033775

CN(C)C(N(C)C)=[N+](C)C.O=[N+]([O-])[O-]

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA5A P35218 1/20 0.32
CA5B Q9Y2D0 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
SCHEMBL627736 0.84
Bromide SCHEMBL6155997 0.81
Fluoride Ion SCHEMBL1961247 0.81
Nitrous Acid SCHEMBL7032211 0.80 ALDH1A1 (0.32)
Sulfuric Acid SCHEMBL7037387 0.78 MEN1 (0.40) MEN1KMT2A
SCHEMBL5100196 0.72 BCHE (0.33)
Thiocyanic Acid SCHEMBL5096340 0.69
Nitromethane SCHEMBL3273015 0.67 HTT (0.39) KMT2ACA5ACA5B
Methyl Alcohol SCHEMBL27918104 0.65 MEN1 (0.60) MEN1KMT2ACA5ACA5B
SCHEMBL28208010 0.65

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-20030163000-A1 Halogen exchange reactions and catalysts therefor CHORDIP LTD. (GB) 2003-08-28 US disclosed
EP-1288196-A1 Process for the preparation of organo guanidinium salts Chordip Ltd. (GB) 2003-03-05 EP 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-20030163000-A1 Halogen exchange reactions and catalysts therefor WEE2, WEE1, SLC39A11 MEN1 3461/4885KMT2A 483/4885CA5A 3606/4885

“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.