SCHEMBL304042

SCHEMBL304042

Cc1nc(S(=O)(=O)N(Cc2ccccc2)c2cccc(C(=O)NC(C)C)c2)cn1C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
LMNA P02545 3/20 0.46
AVPR2 P30518 1/20 0.42
OXTR P30559 1/20 0.42
AVPR1A P37288 1/20 0.42
AVPR1B P47901 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CTSD P07339 1/20 0.42
BACE1 P56817 1/20 0.42
BACE2 Q9Y5Z0 1/20 0.42
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 2/20 0.39
GRM2 Q14416 1/20 0.39
MEN1 O00255 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL2214352 0.92 KDM4E (0.42) MAPTLMNAAVPR2OXTRAVPR1A
SCHEMBL3377153 0.88 LMNA (0.56) MAPTLMNAAVPR2OXTRAVPR1A
SCHEMBL312209 0.85 AVPR2 (0.41) MAPTLMNAAVPR2OXTRAVPR1A
SCHEMBL3378155 0.84 FNTA (0.44) MAPTLMNAAVPR2OXTRAVPR1A
SCHEMBL302565 0.83 MAPT (0.45) MAPTLMNAALDH1A1CTSDBACE1
SCHEMBL302225 0.81 LMNA (0.60) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL2214077 0.81 LMNA (0.46) MAPTLMNAAVPR2OXTRAVPR1A
SCHEMBL303267 0.80 KLKB1 (0.37) MAPTLMNAALDH1A1KMT2AMEN1
SCHEMBL3376222 0.80 MAPT (0.45) MAPTLMNAALDH1A1CTSDBACE1
SCHEMBL302006 0.79 MAPT (0.46) MAPTLMNAOXTRALDH1A1CTSD

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-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 MAPT 2884/4885LMNA 1619/4885AVPR2 369/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 MAPT 4874/4885LMNA 2145/4885AVPR2 375/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 MAPT 2884/4885LMNA 1619/4885AVPR2 369/4885

“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.