SCHEMBL26239233

SCHEMBL26239233

COC(=O)C(Cc1ccc([N+](=O)[O-])cc1)N(C)CCOc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.55
MAPT P10636 3/20 0.47
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAOB P27338 1/20 0.45
ACHE P22303 1/20 0.45
SLC6A4 P31645 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL26239251 0.88 KCNH2 (0.57) KCNH2MAPTCRHBPCRHR2MAOB
SCHEMBL26239231 0.83 PPARG (0.44) L3MBTL1
SCHEMBL9763578 0.78 GAA (0.43) MAPTGAA
SCHEMBL29575512 0.77 LMNA (0.45) KCNH2MAPTGAA
SCHEMBL26239235 0.77 ALDH1A1 (0.54) KCNH2MAPTCRHBPCRHR2L3MBTL1
SCHEMBL29576677 0.76 LMNA (0.44) KCNH2MAPTGAA
SCHEMBL26239239 0.75 KCNH2 (0.54) KCNH2ACHE
SCHEMBL7281801 0.75 MEN1 (0.52) MAPTCRHBPCRHR2
SCHEMBL2478557 0.75 KCNH2 (0.60) KCNH2MAPTACHEGAA
SCHEMBL2234342 0.73 PTPRB (0.52) MAPTGAA

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-20240025846-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS ACAD PHARMACEUTICALS INC (US) 2024-01-25 US disclosed
US-11731938-B2 Ultra short acting anti-arrhythmic agents ACADEMIC PHARMACEUTICALS INC (US) 2023-08-22 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-11731938-B2 Ultra short acting anti-arrhythmic agents CACNA1G, SCN5A, CACNA1F KCNH2 51/4885MAPT 3515/4885CRHBP 3730/4885
US-20240025846-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS CACNA1G, SCN5A, CACNA1F KCNH2 51/4885MAPT 3515/4885CRHBP 3730/4885

“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.