SCHEMBL3748973

SCHEMBL3748973

COc1cc(CCN2C(=O)c3ccccc3C2C(=O)NC(C)(C)C)cc(OC)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.57
KCNH2 Q12809 9/20 0.57
SCN9A Q15858 6/20 0.53
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SCN5A Q14524 3/20 0.48
TP53 P04637 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
SCHEMBL3943527 0.84 KCNA5 (0.56) KCNA5KCNH2SCN9AKMT2ASCN5A
SCHEMBL3755040 0.84 KCNH2 (0.58) KCNA5KCNH2SCN9ASCN5A
SCHEMBL3751061 0.83 KMT2A (0.56) KCNA5KCNH2SCN9AKMT2AALDH1A1
SCHEMBL3762841 0.82 KCNA5 (0.58) KCNA5KCNH2SCN9ASCN5ATP53
SCHEMBL3751859 0.82 KCNA5 (0.67) KCNA5KCNH2SCN9ASCN5A
SCHEMBL3755957 0.80 SCN9A (0.61) KCNA5KCNH2SCN9ASCN5A
SCHEMBL3750458 0.80 KCNA5 (0.66) KCNA5KCNH2ALDH1A1
SCHEMBL3755948 0.80 KCNA5 (0.55) KCNA5KCNH2SCN9AKMT2AALDH1A1
SCHEMBL3748905 0.79 KCNA5 (0.62) KCNA5KCNH2ALDH1A1
SCHEMBL3751649 0.79 GAA (0.59) KCNA5KCNH2KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US claimed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 US claimed
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US disclosed
EP-2049484-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS AstraZeneca AB (SE) 2009-04-22 EP disclosed
WO-2008008022-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS ASTRAZENECA AB (SE) 2008-01-17 WO disclosed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 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 (2 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-20080015237-A1 NEW COMPOUNDS I/418 KCNH1, KCNH2, KCNH3 KCNA5 69/4885KCNH2 2/4885SCN9A 119/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885SCN9A 177/4885

“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.