SCHEMBL2188175

SCHEMBL2188175

CC(C)NC(=O)c1cc(N(Cc2ccc(Cl)cc2)S(=O)(=O)c2ccnn2C)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGER1 P34995 1/20 0.37
CNR2 P34972 3/20 0.37
CNR1 P21554 3/20 0.37
LMNA P02545 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 3/20 0.36
ALDH1A1 P00352 3/20 0.36
NAMPT P43490 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PTPN22 Q9Y2R2 2/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL303235 0.92 MAPT (0.41) LMNAMEN1KMT2AMAPTNAMPT
SCHEMBL303877 0.91 AVPR1B (0.33) NPC1HTTSMN1; SMN2PTGER1CNR2
SCHEMBL2188016 0.85 KDM4E (0.43) NPC1HTTPTGER1LMNAMEN1
SCHEMBL303174 0.83 HTT (0.41) NPC1HTTSMN1; SMN2CNR2CNR1
SCHEMBL303136 0.82 HTT (0.38) NPC1HTTSMN1; SMN2CNR2CNR1
SCHEMBL3376447 0.81 AVPR2 (0.37) HTTSMN1; SMN2CNR2CNR1LMNA
SCHEMBL303299 0.81 NAMPT (0.48) NPC1HTTSMN1; SMN2CNR2CNR1
SCHEMBL18487075 0.77 NAMPT (0.42) NPC1HTTSMN1; SMN2CNR2CNR1
SCHEMBL2214141 0.77 SLC6A9 (0.36) NPC1HTTSMN1; SMN2CNR2CNR1
SCHEMBL303295 0.77 LMNA (0.48) NPC1HTTSMN1; SMN2PTGER1LMNA

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 12 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
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
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 (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 NPC1 628/4885HTT 2305/4885SMN1; SMN2 2793/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 NPC1 905/4885HTT 2035/4885SMN1; SMN2 2258/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 NPC1 628/4885HTT 2305/4885SMN1; SMN2 2793/4885

“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.