SCHEMBL3376969

SCHEMBL3376969

CC(C)(C)OC(=O)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.60
ALDH1A1 P00352 1/20 0.60
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
MAPT P10636 5/20 0.52
ESR1 P03372 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.49
HTT P42858 1/20 0.49
NR1I2 O75469 1/20 0.48
NR3C1 P04150 1/20 0.48
PTGES O14684 2/20 0.47
ALOX5 P09917 1/20 0.47
SLC7A5 Q01650 1/20 0.47

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
SCHEMBL3379944 0.93 MAPT (0.55) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3378945 0.92 LMNA (0.56) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3376355 0.88 KMT2A (0.50) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL3374481 0.88 KCNA5 (0.49) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3275261 0.87 PTGES (0.59) LMNAALDH1A1ESR1L3MBTL1GAA
SCHEMBL2214077 0.86 LMNA (0.46) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL2189346 0.83 LMNA (0.85) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3380883 0.83 LMNA (0.43) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3375607 0.82 FNTA (0.56) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3375719 0.82 LMNA (0.60) LMNAALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2342177-B1 NOVEL POTASSIUM CHANNEL BLOCKERS JAPAN TOBACCO INC (JP) 2017-02-15 EP disclosed
US-9447033-B2 Potassium channel blockers JAPAN TOBACCO INC. (JP) 2016-09-20 US disclosed
US-20150259282-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2015-09-17 US disclosed
US-9073834-B2 Potassium channel blockers XENTION LIMITED (GB) 2015-07-07 US disclosed
US-20140221337-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2014-08-07 US disclosed
US-8673901-B2 Potassium channel blockers XENTION LIMITED (GB) 2014-03-18 US disclosed
US-20100087428-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 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 (3 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-20140221337-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 LMNA 1619/4885ALDH1A1 1360/4885MEN1 608/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 LMNA 2145/4885ALDH1A1 3795/4885MEN1 2747/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 LMNA 1619/4885ALDH1A1 1360/4885MEN1 608/4885

“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.