SCHEMBL3755684

SCHEMBL3755684

O=C(NCc1ccc(OC(F)F)cc1)C1c2ccccc2C(=O)N1Cc1ccc(F)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.60
PRMT5 O14744 5/20 0.51
WDR77 Q9BQA1 5/20 0.51
SCN9A Q15858 6/20 0.50
SCN5A Q14524 4/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.50
KCNH2 Q12809 4/20 0.49
KCNA5 P22460 3/20 0.49
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL3763248 0.86 SCN9A (0.58) SCN9ASCN5AKCNH2KCNA5
SCHEMBL3755617 0.85 KCNA5 (0.68) P2RX7PRMT5WDR77SCN9ASCN5A
SCHEMBL3756795 0.85 P2RX7 (0.64) P2RX7PRMT5WDR77ALDH1A1POLB
SCHEMBL3750338 0.84 P2RX7 (0.63) P2RX7PRMT5WDR77ALDH1A1POLB
SCHEMBL3750467 0.83 P2RX7 (0.59) P2RX7PRMT5WDR77SCN9ASCN5A
SCHEMBL3751258 0.82 P2RX7 (0.60) P2RX7PRMT5WDR77POLBKCNA5
SCHEMBL3750209 0.82 P2RX7 (0.60) P2RX7PRMT5WDR77SCN9ASCN5A
SCHEMBL3762599 0.81 ALDH1A1 (0.66) P2RX7PRMT5WDR77SCN9ASCN5A
SCHEMBL3758555 0.81 P2RX7 (0.59) P2RX7PRMT5WDR77SCN9ASCN5A
SCHEMBL3750441 0.80 SCN9A (0.61) SCN9ASCN5AKCNH2KCNA5

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 P2RX7 1839/4885PRMT5 1341/4885WDR77 2402/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 P2RX7 1138/4885PRMT5 683/4885WDR77 2954/4885

“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.