SCHEMBL3754762

SCHEMBL3754762

CCCCNC(=O)C1c2ccc(OC)cc2C(=O)N1CC(C)(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 7/20 0.56
KCNH2 Q12809 2/20 0.52
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
NPSR1 Q6W5P4 2/20 0.45
TSHR P16473 1/20 0.43
SCN9A Q15858 1/20 0.42
TP53 P04637 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL3750808 0.88 KCNA5 (0.54) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3761468 0.87 KCNH2 (0.54) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3750316 0.81 KCNA5 (0.73) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3748953 0.79 KCNA5 (0.84) KCNA5KCNH2ALDH1A1SCN9ATP53
SCHEMBL3750232 0.77 KCNA5 (0.54) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3758517 0.75 KCNA5 (0.74) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3761013 0.75 KCNA5 (0.74) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3750370 0.75 SCN9A (0.48) KCNA5ALDH1A1SMN1; SMN2LMNANPSR1
SCHEMBL3751061 0.73 KMT2A (0.56) KCNA5KCNH2ALDH1A1SMN1; SMN2LMNA
SCHEMBL3755348 0.70 GAA (0.68) KCNA5KCNH2ALDH1A1SMN1; SMN2NPSR1

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 2/4885ALDH1A1 315/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885ALDH1A1 310/4885

“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.