SCHEMBL3752197

SCHEMBL3752197

CC1(C)COC(c2ccc(F)cc2C=O)=N1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
IL2 P60568 1/20 0.38
GRM2 Q14416 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
CYP2D6 P10635 1/20 0.36
ABL1 P00519 1/20 0.35
PGR P06401 1/20 0.35

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
SCHEMBL8819228 0.87 ATM (0.45) ATMLMNAMAPTHTTKDM4E
SCHEMBL3753188 0.83 XDH (0.44) ATMLMNAMAPTHTTKDM4E
SCHEMBL8818334 0.81 ATM (0.49) ATMLMNAMAPTHTTKDM4E
SCHEMBL711918 0.81 KDM4E (0.39) ATMLMNAMAPTHTTKDM4E
SCHEMBL6587304 0.81 ERN1 (0.43) LMNAMAPTHTTKDM4EHRH3
SCHEMBL9330422 0.81 ATM (0.48) ATMLMNAMAPTHTTKDM4E
SCHEMBL499545 0.78 ATM (0.46) ATMLMNAMAPTHTTKDM4E
SCHEMBL11836656 0.78 ATM (0.58) ATMLMNAMAPTHTTKDM4E
SCHEMBL9607486 0.78 ATM (0.46) ATMLMNAMAPTHTTKDM4E
SCHEMBL9330931 0.78 ATM (0.51) ATMLMNAMAPTHTTKDM4E

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 5 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 disclosed
CN-101528690-A Isoindoline derivatives for the treatment of arrhythmias ASTRAZENECA AB (SE) 2009-09-09 CN 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 ATM 4357/4885LMNA 228/4885MAPT 4504/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 ATM 2001/4885LMNA 461/4885MAPT 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.