SCHEMBL3754015

SCHEMBL3754015

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

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.77
P2RX7 Q99572 1/20 0.46
KCNH2 Q12809 2/20 0.45
SCN9A Q15858 2/20 0.45
SCN5A Q14524 1/20 0.43
ALDH1A1 P00352 4/20 0.41
PRMT5 O14744 4/20 0.41
WDR77 Q9BQA1 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
METAP2 P50579 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
XIAP P98170 2/20 0.39

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
SCHEMBL3756535 0.91 KCNA5 (0.64) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3750669 0.89 KCNA5 (0.86) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3752643 0.88 KCNA5 (0.81) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3755840 0.88 KCNA5 (0.77) KCNA5KCNH2SCN9ASCN5AALDH1A1
SCHEMBL3745315 0.88 KCNA5 (0.77) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3754228 0.88 KCNA5 (0.77) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3755943 0.87 KCNA5 (1.00) KCNA5P2RX7KCNH2SCN9ASCN5A
SCHEMBL3752007 0.86 KCNA5 (0.55) KCNA5P2RX7TSHR
SCHEMBL3756814 0.86 KCNA5 (0.74) KCNA5KCNH2SCN9ASCN5AALDH1A1
SCHEMBL3744033 0.85 KCNA5 (0.80) KCNA5P2RX7KCNH2SCN9ASCN5A

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 1839/4885KCNH2 2/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885P2RX7 1138/4885KCNH2 2/4885

“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.