SCHEMBL26239281

SCHEMBL26239281

COC(=O)CC(O)CNC(=O)c1cc([N+](=O)[O-])ccc1OCCN(C)CCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.49
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
CDC25C P30307 3/20 0.40
THRB P10828 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
AKR1C3 P42330 2/20 0.40
CNR2 P34972 1/20 0.39
POLB P06746 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL26239268 0.88 KCNH2 (0.54) KCNH2MEN1KMT2ANPC1CDC25C
SCHEMBL26239278 0.84 KCNH2 (0.39) KCNH2CNR2
SCHEMBL26239253 0.82 KCNH2 (0.61) KCNH2MEN1KMT2ACDC25CTHRB
SCHEMBL26240216 0.81 KCNH2 (0.52) KCNH2
SCHEMBL26239269 0.80 KCNH2 (0.63) KCNH2MEN1KMT2ACDC25CTHRB
SCHEMBL26239282 0.76 KCNH2 (0.47) KCNH2
SCHEMBL10721556 0.71 KCNH2 (0.62) KCNH2MEN1KMT2ACDC25CTHRB
SCHEMBL24601338 0.71 KCNH2 (0.42) KCNH2BLMCNR2SIGMAR1
SCHEMBL6572919 0.68 KCNH2 (0.61) KCNH2MEN1KMT2ACDC25CTHRB
SCHEMBL3929250 0.68 KCNH2 (1.00) KCNH2CDC25CSIGMAR1

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 51/4885MEN1 4508/4885KMT2A 3188/4885
US-20240025846-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS CACNA1G, SCN5A, CACNA1F KCNH2 51/4885MEN1 4508/4885KMT2A 3188/4885

“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.