SCHEMBL3754228

SCHEMBL3754228

C[C@@H](c1ccccc1)N1C(=O)c2ccc(Cl)cc2C1C(=O)NCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 4/20 0.77
P2RX7 Q99572 3/20 0.47
NR3C2 P08235 2/20 0.44
BRS3 P32247 1/20 0.44
KCNH2 Q12809 3/20 0.43
SCN9A Q15858 2/20 0.43
PANK3 Q9H999 1/20 0.42
PTGES O14684 1/20 0.41
SCN5A Q14524 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CNR1 P21554 1/20 0.40

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
SCHEMBL3745315 1.00 KCNA5 (0.77) KCNA5P2RX7NR3C2BRS3KCNH2
SCHEMBL3752066 0.91 KCNA5 (0.64) KCNA5P2RX7NR3C2BRS3KCNH2
SCHEMBL3755647 0.90 KCNA5 (0.61) KCNA5P2RX7BRS3KCNH2SCN9A
SCHEMBL3758325 0.90 KCNA5 (0.61) KCNA5P2RX7NR3C2BRS3KCNH2
SCHEMBL3754015 0.88 KCNA5 (0.77) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3755840 0.88 KCNA5 (0.77) KCNA5KCNH2SCN9ASCN5AALDH1A1
SCHEMBL3755943 0.87 KCNA5 (1.00) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3749096 0.86 KCNA5 (0.55) KCNA5P2RX7BRS3KCNH2PTGES
SCHEMBL3756814 0.86 KCNA5 (0.74) KCNA5NR3C2KCNH2SCN9ASCN5A
SCHEMBL3754303 0.84 KCNA5 (0.54) KCNA5P2RX7BRS3KCNH2PTGES

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 6 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
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 69/4885P2RX7 1839/4885NR3C2 1692/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885P2RX7 1138/4885NR3C2 1758/4885

“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.