SCHEMBL3755269

SCHEMBL3755269

CC(C)CN1C(=O)c2ccccc2C1C(=O)NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.55
TDP1 Q9NUW8 1/20 0.54
KCNA5 P22460 6/20 0.53
KCNH2 Q12809 2/20 0.52
KMT2A Q03164 1/20 0.49
SCN9A Q15858 5/20 0.47
SCN5A Q14524 4/20 0.47
TP53 P04637 1/20 0.46

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
SCHEMBL3758305 0.90 KMT2A (0.61) P2RX7TDP1KCNA5KCNH2KMT2A
SCHEMBL3750590 0.88 P2RX7 (0.57) P2RX7TDP1KCNA5KCNH2KMT2A
SCHEMBL3758533 0.86 P2RX7 (0.55) P2RX7TDP1KCNA5KCNH2SCN9A
SCHEMBL3756430 0.84 SCN9A (0.57) P2RX7TDP1KCNH2SCN9ASCN5A
SCHEMBL3756919 0.83 P2RX7 (0.52) P2RX7TDP1KCNA5KCNH2SCN9A
SCHEMBL3753475 0.81 TDP1 (0.54) P2RX7TDP1KCNA5KCNH2KMT2A
SCHEMBL3756000 0.80 KCNA5 (0.67) P2RX7TDP1KCNA5KCNH2KMT2A
SCHEMBL3749997 0.80 SCN9A (0.57) TDP1KCNA5KCNH2SCN9ASCN5A
SCHEMBL3892016 0.79 SCN9A (0.75) KCNA5KCNH2SCN9ASCN5A
SCHEMBL3758534 0.78 KCNA5 (0.59) P2RX7TDP1KCNA5KCNH2KMT2A

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 1839/4885TDP1 2095/4885KCNA5 69/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 P2RX7 1138/4885TDP1 1271/4885KCNA5 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.