SCHEMBL3758674

SCHEMBL3758674

O=C(NCc1ccc(C(F)(F)F)nc1)C1c2cc(Cl)ccc2C(=O)N1Cc1ccccc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.57
KCNH2 Q12809 7/20 0.48
SCN9A Q15858 5/20 0.46
SCN5A Q14524 3/20 0.46
P2RX7 Q99572 2/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL3751877 0.91 KCNA5 (0.68) KCNA5KCNH2SCN9ASCN5APRMT5
SCHEMBL3751952 0.86 KCNA5 (0.69) KCNA5KCNH2P2RX7ALDH1A1POLB
SCHEMBL3753827 0.85 KCNA5 (0.66) KCNA5KCNH2SCN9ASCN5AP2RX7
SCHEMBL3750211 0.83 KCNA5 (0.81) KCNA5KCNH2SCN9ASCN5AP2RX7
SCHEMBL3750222 0.81 KCNA5 (0.56) KCNA5KCNH2P2RX7
SCHEMBL3755635 0.80 P2RX7 (0.54) KCNA5KCNH2SCN9ASCN5AP2RX7
SCHEMBL5138957 0.80 KCNA5 (0.60) KCNA5KCNH2P2RX7
SCHEMBL5139114 0.80 KCNA5 (0.60) KCNA5KCNH2P2RX7
SCHEMBL3755934 0.80 KCNA5 (0.60) KCNA5KCNH2P2RX7
SCHEMBL3755508 0.80 KCNA5 (0.53) KCNA5KCNH2P2RX7

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 5 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-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.