SCHEMBL3377009

SCHEMBL3377009

O=C(Nc1ccc(-n2ccnc2)cc1)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.61
LMNA P02545 5/20 0.61
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 1/20 0.51
NAMPT P43490 1/20 0.49
GAA P10253 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP4Z1 Q86W10 1/20 0.47
GFER P55789 1/20 0.47
ROCK2 O75116 1/20 0.46

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
SCHEMBL3376225 0.86 MAPT (0.61) MAPTLMNAKDM4EKMT2ANAMPT
SCHEMBL3377228 0.84 MAPT (0.74) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL3378728 0.81 MAPT (0.70) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL3377793 0.77 MAPT (0.64) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL3380451 0.76 MAPT (0.63) MAPTLMNAKMT2ANAMPTHTT
SCHEMBL3380407 0.75 LMNA (0.64) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL2213597 0.75 MAPT (0.58) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL3378810 0.75 NPC1 (0.60) MAPTLMNAROCK2
SCHEMBL3379001 0.75 KMT2A (0.66) MAPTLMNAKDM4EKMT2AGAA
SCHEMBL2186493 0.74 ALDH1A1 (0.62) MAPTLMNAKDM4EKMT2ANAMPT

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-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

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 1619/4885KDM4E 371/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 MAPT 4874/4885LMNA 2145/4885KDM4E 1379/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 MAPT 2884/4885LMNA 1619/4885KDM4E 371/4885

“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.