SCHEMBL3758616

SCHEMBL3758616

Cc1c(O)ccc2c1C(=O)N(Cc1ccc(F)c(F)c1)C2C(=O)NCc1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.51
KCNH2 Q12809 3/20 0.51
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PRMT5 O14744 5/20 0.42
WDR77 Q9BQA1 5/20 0.42
SCN9A Q15858 2/20 0.42
SCN5A Q14524 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
S1PR3 Q99500 1/20 0.41
FPR1 P21462 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL3747728 0.87 KCNA5 (0.53) KCNA5KCNH2PRMT5WDR77SCN9A
SCHEMBL3754019 0.83 KCNA5 (0.55) KCNA5KCNH2ALDH1A1SMN1; SMN2
SCHEMBL3757213 0.82 KCNA5 (0.57) KCNA5KCNH2
SCHEMBL3750877 0.81 KCNA5 (0.58) KCNA5KCNH2SCN9A
SCHEMBL3751667 0.80 KCNA5 (0.72) KCNA5KCNH2
SCHEMBL3750216 0.79 KCNA5 (0.56) KCNA5KCNH2PRMT5WDR77SCN9A
SCHEMBL3750271 0.73 PRMT5 (0.49) KCNA5KCNH2ALDH1A1POLBPRMT5
SCHEMBL3751530 0.72 KCNA5 (0.46) KCNA5KCNH2ALDH1A1POLBSCN9A
SCHEMBL3750823 0.72 PRMT5 (0.61) KCNA5KCNH2ALDH1A1PRMT5WDR77
SCHEMBL3758976 0.71 KCNA5 (0.75) KCNA5KCNH2

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 2/4885CYP3A4 74/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885CYP3A4 140/4885

“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.