SCHEMBL3755613

SCHEMBL3755613

Cc1ccc(-c2ccccc2CN2C(=O)c3ccccc3C2C(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 12/20 0.64
KCNH2 Q12809 4/20 0.54
ALDH1A1 P00352 2/20 0.49
PRMT5 O14744 2/20 0.46
WDR77 Q9BQA1 2/20 0.46
POLB P06746 1/20 0.45
SCN5A Q14524 1/20 0.45
SCN9A Q15858 1/20 0.45

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
SCHEMBL3757969 0.92 KCNA5 (0.64) KCNA5KCNH2PRMT5WDR77SCN5A
SCHEMBL3751864 0.91 KCNA5 (0.61) KCNA5KCNH2ALDH1A1POLBSCN5A
SCHEMBL3752336 0.88 KCNA5 (0.66) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3750384 0.85 KCNA5 (0.56) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3753833 0.84 KCNA5 (0.53) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3751985 0.83 KCNA5 (0.86) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3750851 0.82 KCNA5 (0.78) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3950176 0.81 KCNA5 (0.64) KCNA5KCNH2ALDH1A1
SCHEMBL3756082 0.80 KCNA5 (0.55) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3757767 0.80 KCNA5 (0.78) KCNA5KCNH2PRMT5WDR77SCN5A

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 8 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
EP-2049484-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS AstraZeneca AB (SE) 2009-04-22 EP claimed
WO-2008008022-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS ASTRAZENECA AB (SE) 2008-01-17 WO 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 2/4885ALDH1A1 315/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885ALDH1A1 310/4885

“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.