SCHEMBL1243354

SCHEMBL1243354

CCCCCC(N1CCOCC1)C(O)(c1cccnc1)c1cccnc1

nearest known ligand 0.98

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 14/20 0.98
KCNH2 Q12809 9/20 0.98
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 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
SCHEMBL1242942 0.99 KCNA5 (1.00) KCNA5KCNH2MEN1KMT2AKDM4E
SCHEMBL1242083 0.97 KCNA5 (1.00) KCNA5KCNH2MEN1KMT2AKDM4E
SCHEMBL1243261 0.92 KCNA5 (0.87) KCNA5KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL1242194 0.87 KCNA5 (0.78) KCNA5KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL1242917 0.82 KCNA5 (0.79) KCNA5KCNH2ALDH1A1
SCHEMBL1243073 0.79 KCNA5 (1.00) KCNA5KCNH2ALDH1A1
SCHEMBL1242050 0.78 KCNA5 (0.76) KCNA5KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL1242858 0.76 KCNA5 (1.00) KCNA5KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL1240366 0.73 KCNA5 (1.00) KCNA5KCNH2ALDH1A1
SCHEMBL9902767 0.73 KCNA5 (0.93) KCNA5KCNH2MEN1KMT2AKDM4E

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 3/4885MEN1 2152/4885

“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.