SCHEMBL3750370

SCHEMBL3750370

COc1cc2c(cc1OC)C(C(=O)NCc1ccccc1)N(CC(C)(C)c1ccccc1)C2=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.48
KCNA5 P22460 4/20 0.48
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TP53 P04637 1/20 0.44
TNF P01375 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL3761468 0.88 KCNH2 (0.54) SCN9AKCNA5ALDH1A1POLBLMNA
SCHEMBL3750808 0.87 KCNA5 (0.54) KCNA5ALDH1A1POLBKMT2ALMNA
SCHEMBL3744437 0.80 KCNA5 (0.65) KCNA5ALDH1A1POLBKMT2ALMNA
SCHEMBL3745476 0.77 KCNA5 (0.59) SCN9AKCNA5ALDH1A1POLBKMT2A
SCHEMBL3760742 0.77 KCNA5 (0.58) KCNA5ALDH1A1POLBKMT2ALMNA
SCHEMBL3755914 0.77 KCNA5 (0.56) KCNA5ALDH1A1POLBKMT2ALMNA
SCHEMBL3757666 0.77 KMT2A (0.46) SCN9AKCNA5ALDH1A1POLBKMT2A
SCHEMBL3750363 0.75 KCNA5 (0.60) SCN9AKCNA5ALDH1A1
SCHEMBL3754762 0.75 KCNA5 (0.56) SCN9AKCNA5ALDH1A1KMT2ALMNA
SCHEMBL3750006 0.72 ALDH1A1 (0.66) SCN9AKCNA5ALDH1A1POLBKMT2A

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 SCN9A 119/4885KCNA5 69/4885ALDH1A1 315/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 SCN9A 177/4885KCNA5 72/4885ALDH1A1 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.