SCHEMBL3751231

SCHEMBL3751231

O=C(NCc1ccccc1)C1c2ccccc2C(=O)N1Cc1cccc(F)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 7/20 0.61
WDR77 Q9BQA1 7/20 0.61
KCNA5 P22460 4/20 0.58
ALDH1A1 P00352 2/20 0.52
SCN9A Q15858 3/20 0.52
KCNH2 Q12809 1/20 0.52
SCN5A Q14524 2/20 0.52
P2RX7 Q99572 1/20 0.50

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
SCHEMBL3748526 0.89 KCNA5 (0.67) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3750823 0.88 PRMT5 (0.61) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3756269 0.86 KCNA5 (0.61) PRMT5WDR77KCNA5ALDH1A1KCNH2
SCHEMBL3751608 0.86 P2RX7 (0.61) PRMT5WDR77KCNA5SCN9AKCNH2
SCHEMBL3762772 0.85 SCN9A (0.56) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3750421 0.84 KCNA5 (0.55) PRMT5WDR77KCNA5SCN9AKCNH2
SCHEMBL3750249 0.84 KCNA5 (0.56) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3750436 0.84 ALDH1A1 (0.63) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3762591 0.83 KCNA5 (0.64) PRMT5WDR77KCNA5ALDH1A1SCN9A
SCHEMBL3750652 0.83 SCN9A (0.60) PRMT5WDR77KCNA5ALDH1A1SCN9A

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 PRMT5 1341/4885WDR77 2402/4885KCNA5 69/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 PRMT5 683/4885WDR77 2954/4885KCNA5 72/4885

“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.