SCHEMBL3757697

SCHEMBL3757697

O=C(NCCCC(F)(F)F)C1c2cc(Cl)ccc2C(=O)N1C(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 8/20 0.42
KCNH2 Q12809 2/20 0.42
BRS3 P32247 2/20 0.42
P2RX7 Q99572 5/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
SCN9A Q15858 2/20 0.35
SCN5A Q14524 1/20 0.35

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
SCHEMBL3751700 0.91 KCNA5 (0.53) KCNA5KCNH2BRS3P2RX7SCN9A
SCHEMBL3746172 0.90 KCNA5 (0.43) KCNA5KCNH2BRS3P2RX7SCN9A
SCHEMBL3755150 0.88 KCNA5 (0.53) KCNA5KCNH2P2RX7SCN9ASCN5A
SCHEMBL3751379 0.85 KCNA5 (0.54) KCNA5KCNH2BRS3P2RX7CNR1
SCHEMBL3750444 0.83 KCNA5 (0.48) KCNA5KCNH2BRS3P2RX7CNR1
SCHEMBL3755647 0.82 KCNA5 (0.61) KCNA5KCNH2BRS3P2RX7CNR1
SCHEMBL3750647 0.80 KCNA5 (0.54) KCNA5KCNH2P2RX7SCN9ASCN5A
SCHEMBL3751738 0.79 KCNA5 (0.43) KCNA5KCNH2BRS3P2RX7CNR1
SCHEMBL3748014 0.79 P2RX7 (0.48) KCNA5KCNH2BRS3P2RX7
SCHEMBL3754303 0.79 KCNA5 (0.54) KCNA5KCNH2BRS3P2RX7CNR1

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 2/4885BRS3 665/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885BRS3 440/4885

“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.