SCHEMBL3377116

SCHEMBL3377116

O=C(NC1CC1)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
ALDH1A1 P00352 2/20 0.62
MAPT P10636 4/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ADRB2 P07550 1/20 0.55
RAD52 P43351 2/20 0.53
MITF O75030 1/20 0.51
HSD17B10 Q99714 1/20 0.50
CTSD P07339 1/20 0.49
BACE1 P56817 1/20 0.49
BACE2 Q9Y5Z0 1/20 0.49

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
SCHEMBL3380856 0.96 MEN1 (0.61) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3380604 0.96 LMNA (0.60) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3378120 0.85 CXCR3 (0.57) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL2189346 0.84 LMNA (0.85) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3380407 0.84 LMNA (0.64) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL302132 0.83 ALDH1A1 (0.65) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3380826 0.83 LMNA (0.60) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3377228 0.83 MAPT (0.74) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL2186493 0.83 ALDH1A1 (0.62) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL3377521 0.82 LMNA (0.59) LMNAALDH1A1MAPTMEN1KMT2A

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 13 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 claimed
US-9447033-B2 Potassium channel blockers JAPAN TOBACCO INC. (JP) 2016-09-20 US claimed
US-20150259282-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2015-09-17 US claimed
US-20140221337-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2014-08-07 US claimed
US-20100087428-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US claimed
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
WO-2010023448-A1 NOVEL POTASSIUM CHANNEL BLOCKERS 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 (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 1360/4885MAPT 2884/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 LMNA 2145/4885ALDH1A1 3795/4885MAPT 4874/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 LMNA 1619/4885ALDH1A1 1360/4885MAPT 2884/4885

“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.