SCHEMBL1242854

SCHEMBL1242854

CCOc1ccccc1C(N1CCCC1)C(O)(c1cccnc1)c1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 14/20 0.63
KCNH2 Q12809 10/20 0.63
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL1242141 0.90 KCNA5 (0.67) KCNA5KCNH2MEN1KMT2AKDM4E
SCHEMBL1243647 0.84 KCNA5 (0.63) KCNA5KCNH2SLC6A2SLC6A4KDM4E
SCHEMBL1242869 0.82 KCNA5 (0.70) KCNA5KCNH2KDM4E
SCHEMBL1242855 0.81 KCNA5 (0.58) KCNA5KCNH2KDM4E
SCHEMBL1242840 0.81 KCNA5 (0.64) KCNA5KCNH2MEN1POLBKMT2A
SCHEMBL1242158 0.80 KCNA5 (0.70) KCNA5KCNH2KDM4E
SCHEMBL1243250 0.80 KCNA5 (0.70) KCNA5KCNH2KDM4E
SCHEMBL1240569 0.80 KCNA5 (0.70) KCNA5KCNH2KMT2AKDM4E
SCHEMBL1240545 0.80 KCNA5 (0.57) KCNA5KCNH2KDM4E
SCHEMBL1242084 0.78 KCNA5 (1.00) KCNA5KCNH2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1781635-B1 POTASSIUM CHANNEL INHIBITORS MERCK SHARP & DOHME (US) 2012-06-13 EP disclosed
US-7879839-B2 For treatment and prevention of cardiac arrhythmias; (+-)-2-Morpholin-4-yl-2-phenyl-1,1-dipyridin-3-yl-ethanol; (+-)-2-[(2-methoxyethyl)(methyl)amino]-2-phenyl-1,1-dipyridin-3-ylethanol MERCK SHARP & DOHME CORP. (US) 2011-02-01 US disclosed
US-20080090794-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME LLC 2008-04-17 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-20080090794-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885KCNH2 3/4885SLC6A2 382/4885

“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.