SCHEMBL5217004

SCHEMBL5217004

O=C(Nc1ccc(Cl)nc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 16/20 1.00
KCNQ2 O43526 16/20 1.00
KCNE1 P15382 12/20 0.77
KCNQ1 P51787 12/20 0.77
BACE1 P56817 1/20 0.74
P4HTM Q9NXG6 1/20 0.67
PTPN2 P17706 1/20 0.63
PTPN1 P18031 1/20 0.63
RAB9A P51151 2/20 0.60
KDM4E B2RXH2 1/20 0.60
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.59

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
SCHEMBL14339874 0.91 KCNQ3 (1.00) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL5217440 0.87 KCNQ3 (1.00) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL5215207 0.86 KCNQ3 (0.81) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL5217560 0.85 KCNQ3 (0.79) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL5214418 0.85 KCNQ3 (1.00) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL14340098 0.85 KCNQ3 (0.74) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL14082274 0.85 KCNQ3 (0.74) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL6086307 0.84 KCNQ3 (1.00) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL265831 0.84 KCNQ3 (0.72) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL5213995 0.84 KCNQ3 (0.77) KCNQ3KCNQ2KCNE1KCNQ1BACE1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8259539-A None JP disclosed
EP-1208085-B1 BENZANILIDES AS POTASSIUM CHANNEL OPENERS ICAGEN INC (US) 2007-12-05 EP disclosed
EP-1208085-B1 BENZANILIDES AS POTASSIUM CHANNEL OPENERS ICAGEN INC (US) 2007-12-05 EP disclosed
US-6989398-B2 Benzanilides as potassium channel openers ICAGEN, INC. (US) 2006-01-24 US disclosed
US-20040157829-A1 Benzanilides as potassium channel openers ICAGEN, INC. 2004-08-12 US disclosed
US-6737422-B2 VOLTAGE-DEPENDENT ICAGEN, INC. 2004-05-18 US disclosed
US-6605725-B2 Treating a central or peripheral nervous system disorder or condition through modulation of a voltage-dependent potassium channel ICAGEN, INC. 2003-08-12 US disclosed
EP-1208085-A4 BENZANILIDES AS POTASSIUM CHANNEL OPENERS ICAGEN INC (US) 2003-05-02 EP disclosed
US-6495550-B2 SUBSTITUTED BENZAMIDO-PYRIDINE DERIVATIVES FOR TREATMENT OF DISORDERS MEDIATED BY POTASSIUM CHANNELS ICAGEN, INC. 2002-12-17 US disclosed
EP-0722933-B1 Process for the preparation of chloromethylpyridine derivatives and acylaminomethyl pyridines as intermediates BAYER AG (DE) 2002-10-09 EP disclosed
US-20020091122-A1 Benzanilides as potassium channel openers ICAGEN, INC. (US) 2002-07-11 US disclosed
EP-1208085-A2 BENZANILIDES AS POTASSIUM CHANNEL OPENERS Icagen, Inc. (US) 2002-05-29 EP disclosed
US-20020052393-A1 Benzanilides as potassium channel openers ICAGEN, INC. (US) 2002-05-02 US disclosed
US-6372767-B1 NERVOUS SYSTEM DISORDERS WITH HETEROCYCLIC SUBSTITUTED BEMZANILIDES ICAGEN, INC. 2002-04-16 US disclosed
US-20010049444-A1 Pyridine-substituted benzanilides as potassium ion channel openers ICAGEN, INC. 2001-12-06 US disclosed
WO-2001010380-A2 BENZANILIDES AS POTASSIUM CHANNEL OPENERS ICAGEN, INC. (US) 2001-02-15 WO disclosed
US-5623076-A Process for the preparation of chloromethylpyridines BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
JP-H08259539-A PRODUCTION OF CHLOROMETHYLPYRIDINES BAYER AG 1996-10-08 JP disclosed
EP-0722933-A1 Process for the preparation of chloromethylpyridine derivatives and acylaminomethyl pyridines as intermediates BAYER AG (DE) 1996-07-24 EP 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 (4 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-20040157829-A1 Benzanilides as potassium channel openers KCNJ2, KCNA3, KCNH2 KCNQ3 13/4885KCNQ2 6/4885KCNE1 31/4885
US-20020091122-A1 Benzanilides as potassium channel openers KCNJ2, KCNA3, KCNH2 KCNQ3 13/4885KCNQ2 6/4885KCNE1 31/4885
US-20020052393-A1 Benzanilides as potassium channel openers KCNJ2, KCNA3, KCNH2 KCNQ3 13/4885KCNQ2 6/4885KCNE1 31/4885
US-20010049444-A1 Pyridine-substituted benzanilides as potassium ion channel openers KCNJ2, KCNJ1, KCNN3 KCNQ3 18/4885KCNQ2 12/4885KCNE1 35/4885

“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.