SCHEMBL303235

SCHEMBL303235

CC(C)NC(=O)c1cc(N(Cc2ccccc2)S(=O)(=O)c2ccnn2C)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
NAMPT P43490 1/20 0.40
TP53 P04637 3/20 0.39
MCL1 Q07820 5/20 0.39
MMP9 P14780 1/20 0.39
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PSMB5 P28074 2/20 0.36
POLB P06746 2/20 0.36
BCL2L1 Q07817 1/20 0.36

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
SCHEMBL2188175 0.92 NPC1 (0.38) MAPTNAMPTTP53LMNAMEN1
SCHEMBL3376222 0.84 MAPT (0.45) MAPTLMNAMEN1KMT2A
SCHEMBL3377911 0.84 MAPT (0.54) MAPTTP53MCL1NR1I2MEN1
SCHEMBL303877 0.84 AVPR1B (0.33) MAPTNAMPTLMNAMEN1KMT2A
SCHEMBL303671 0.82 MAPT (0.43) MAPTNAMPTTP53MCL1NR1I2
SCHEMBL3381042 0.81 MEN1 (0.48) MAPTNAMPTTP53MCL1LMNA
SCHEMBL3380874 0.81 NR3C1 (0.54) MAPTTP53MCL1MMP9MEN1
SCHEMBL301986 0.81 NAMPT (0.51) MAPTNAMPTMCL1MMP9NR1I2
SCHEMBL312209 0.81 AVPR2 (0.41) MAPTNAMPTTP53MCL1MMP9
SCHEMBL3379268 0.80 MAPT (0.40) MAPTNAMPTTP53MCL1NR1I2

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-8673901-B2 Potassium channel blockers XENTION LIMITED (GB) 2014-03-18 US claimed
JP-2012500836-A 2012-01-12 JP claimed
EP-2342177-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-07-13 EP claimed
US-20100087428-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US claimed
WO-2010023448-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 WO 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-8673901-B2 Potassium channel blockers XENTION LIMITED (GB) 2014-03-18 US disclosed
EP-2342177-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-07-13 EP 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 (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-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 MAPT 4874/4885NAMPT 2896/4885TP53 4871/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 MAPT 2884/4885NAMPT 2799/4885TP53 4632/4885

“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.