SCHEMBL3378995

SCHEMBL3378995

CC(C)NC(=O)c1cc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2C#N)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
MAPT P10636 3/20 0.41
RORC P51449 2/20 0.41
KAT6A Q92794 1/20 0.41
NR1H2 P55055 1/20 0.40
HSD11B1 P28845 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 2/20 0.39
KCNA5 P22460 1/20 0.39
MCL1 Q07820 2/20 0.39
HTT P42858 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NR3C1 P04150 1/20 0.37
PGR P06401 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
SCHEMBL301832 0.92 LMNA (0.44) LMNAMAPTRORCKAT6ANR1H2
SCHEMBL302950 0.85 NR3C1 (0.55) LMNAMAPTPOLBTP53MCL1
SCHEMBL3377911 0.85 MAPT (0.54) MAPTRORCMEN1KMT2ATP53
SCHEMBL3380436 0.84 NR1H2 (0.45) LMNAMAPTRORCKAT6ANR1H2
SCHEMBL3380874 0.82 NR3C1 (0.54) MAPTMEN1KMT2ATP53MCL1
SCHEMBL3379270 0.80 MAPT (0.49) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL301986 0.78 NAMPT (0.51) LMNAMAPTALDH1A1MCL1HTT
SCHEMBL303293 0.78 GAA (0.63) LMNAMAPTMEN1KMT2AHTT
SCHEMBL303671 0.78 MAPT (0.43) LMNAMAPTMEN1KMT2APOLB
SCHEMBL303235 0.78 MAPT (0.41) LMNAMAPTMEN1KMT2APOLB

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 11 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-9073834-B2 Potassium channel blockers XENTION LIMITED (GB) 2015-07-07 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

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 1619/4885MAPT 2884/4885RORC 3865/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 LMNA 2145/4885MAPT 4874/4885RORC 953/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 LMNA 1619/4885MAPT 2884/4885RORC 3865/4885

“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.