SCHEMBL1711059

SCHEMBL1711059

O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
POLB P06746 2/20 0.67
SLC6A7 Q99884 1/20 0.67
ALDH1A1 P00352 6/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
CA12 O43570 2/20 0.63
CA1 P00915 2/20 0.63
CA2 P00918 2/20 0.63
CA7 P43166 2/20 0.63
CA9 Q16790 2/20 0.63
CA14 Q9ULX7 2/20 0.63
MAPT P10636 4/20 0.62
HTT P42858 3/20 0.62
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
LMNA P02545 1/20 0.61
MAPK1 P28482 1/20 0.61
CRHBP P24387 1/20 0.60

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
SCHEMBL1845373 0.94 ALDH1A1 (0.67) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL16026508 0.93 ALDH1A1 (0.70) KMT2APOLBALDH1A1SMN1; SMN2CA12
SCHEMBL23008882 0.87 ESR1 (0.66) KMT2APOLBALDH1A1SMN1; SMN2CA12
SCHEMBL9152022 0.86 CA12 (0.77) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL10721777 0.86 MEN1 (0.87) MEN1KMT2APOLBSLC6A7ALDH1A1
SCHEMBL6791620 0.86 SMN1; SMN2 (0.63) KMT2APOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL26706248 0.86 NPC1 (0.71) POLBALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL1842455 0.85 LMNA (0.76) MEN1KMT2AALDH1A1SMN1; SMN2CA12
SCHEMBL16026443 0.84 LMNA (0.75) KMT2AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL18996994 0.84 ALDH1A1 (0.78) MEN1KMT2AALDH1A1SMN1; SMN2L3MBTL1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344456-B1 NOVEL POTASSIUM CHANNEL BLOCKER JAPAN TOBACCO INC (JP) 2018-07-25 EP disclosed
US-8258138-B2 Potassium channel blockers XENTION LIMITED (GB) 2012-09-04 US disclosed
EP-2344456-A1 NOVEL POTASSIUM CHANNEL BLOCKER Xention Limited (GB) 2011-07-20 EP disclosed
US-20100087437-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US disclosed
WO-2010023445-A1 NOVEL POTASSIUM CHANNEL BLOCKER XENTION LIMITED (GB) 2010-03-04 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-20100087437-A1 Novel Potassium Channel Blockers KCNB1, KCNJ2, KCNJ11 MEN1 824/4885KMT2A 777/4885POLB 4525/4885

“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.