SCHEMBL3754848

SCHEMBL3754848

COCCNC(=O)C1c2ccccc2C(=O)N1CCO

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
KDM4E B2RXH2 1/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
TSHR P16473 3/20 0.56
KMT2A Q03164 1/20 0.55
TP53 P04637 2/20 0.54
MDM2 Q00987 1/20 0.54
KCNA5 P22460 3/20 0.49
SCN9A Q15858 3/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GAA P10253 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KCNH2 Q12809 1/20 0.48
SCN5A Q14524 1/20 0.48

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
SCHEMBL3760753 0.86 KCNA5 (0.63) ALDH1A1MAPTTSHRKMT2ATP53
SCHEMBL3745484 0.85 TP53 (0.64) ALDH1A1KDM4EMAPTHTTTSHR
SCHEMBL3754140 0.84 KCNA5 (0.58) ALDH1A1TSHRKMT2ATP53KCNA5
SCHEMBL3758084 0.83 ALDH1A1 (0.67) ALDH1A1KMT2ATP53KCNA5SCN9A
SCHEMBL3753009 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTHTTTSHR
SCHEMBL3749308 0.80 KCNA5 (0.64) ALDH1A1TSHRKMT2ATP53KCNA5
SCHEMBL3755348 0.78 GAA (0.68) ALDH1A1MAPTTSHRKMT2ATP53
SCHEMBL3752701 0.78 KCNA5 (0.82) ALDH1A1KDM4EMAPTHTTTSHR
SCHEMBL3752084 0.77 GAA (0.58) ALDH1A1TSHRKMT2ATP53KCNA5
SCHEMBL3755669 0.76 GAA (0.62) ALDH1A1TSHRKMT2ATP53KCNA5

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 ALDH1A1 315/4885KDM4E 4057/4885MAPT 4504/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 ALDH1A1 310/4885KDM4E 4100/4885MAPT 4244/4885

“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.