SCHEMBL14083399

SCHEMBL14083399

COc1cccnc1-c1ccc(C(=O)Nc2ccc(Cl)nc2)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 18/20 0.62
▸ KCNQ2 O43526 18/20 0.62
▸ KCNE1 P15382 11/20 0.59
▸ KCNQ1 P51787 11/20 0.59
▸ LMNA P02545 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ MITF O75030 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ BACE1 P56817 1/20 0.49

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
SCHEMBL14083312 0.94 KCNQ3 (0.64) KCNQ3KCNQ2KCNE1KCNQ1LMNA
SCHEMBL14083392 0.91 SMN1; SMN2 (0.56) KCNQ3KCNQ2KCNE1KCNQ1LMNA
SCHEMBL14083110 0.90 KCNQ3 (0.72) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL14083788 0.90 KCNQ3 (0.62) KCNQ3KCNQ2KCNE1KCNQ1LMNA
SCHEMBL14083379 0.89 TRPV1 (0.55) KCNQ3KCNQ2KDM4EMEN1MAPT
SCHEMBL14083380 0.88 GRM4 (0.61) LMNAKDM4EMEN1ALDH1A1MAPT
SCHEMBL14083377 0.88 AURKB (0.54) LMNAKDM4EMEN1ALDH1A1MAPT
SCHEMBL14083397 0.88 MAPT (0.47) KCNQ3KCNQ2LMNAKDM4EMEN1
SCHEMBL14083384 0.87 TRPV1 (0.55) KCNQ3KCNQ2KDM4EMEN1MAPT
SCHEMBL14083383 0.86 TRPV1 (0.62) MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — 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 (1 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 KCNQ3 87/4885KCNQ2 67/4885KCNE1 94/4885

“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.

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