SCHEMBL3752070

SCHEMBL3752070

CC(NC(=O)C1c2cc(F)ccc2C(=O)N1CC(C)(C)C)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.48
KCNH2 Q12809 2/20 0.44
SCN5A Q14524 1/20 0.44
SCN9A Q15858 1/20 0.44
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.40
MTOR P42345 1/20 0.39
CACNA1G O43497 1/20 0.39
GPR139 Q6DWJ6 1/20 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
SCHEMBL3757690 0.81 KCNA5 (0.53) KCNA5CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL3946919 0.80 ALDH1A1 (0.51) KCNA5KCNH2
SCHEMBL3751131 0.78 KCNA5 (0.49) KCNA5KCNH2SCN9A
SCHEMBL3753991 0.77 KCNA5 (0.48) KCNA5KCNH2SCN5ASCN9A
SCHEMBL3760228 0.72 KCNA5 (0.53) KCNA5KCNH2
SCHEMBL3750040 0.71 KCNA5 (0.57) KCNA5KCNH2
SCHEMBL3750421 0.71 KCNA5 (0.55) KCNA5KCNH2SCN5ASCN9A
SCHEMBL3757977 0.71 KCNA5 (0.64) KCNA5KCNH2SCN5ASCN9A
SCHEMBL3752007 0.70 KCNA5 (0.55) KCNA5
SCHEMBL3753743 0.69 MAPT (0.57) KCNA5KCNH2SCN9A

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 4 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
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 69/4885KCNH2 2/4885SCN5A 48/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885KCNH2 2/4885SCN5A 26/4885

“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.