SCHEMBL3758346

SCHEMBL3758346

Fc1ccc([CH]c2cccnc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 7/20 0.48
CYP11B2 P19099 4/20 0.48
CYP11B1 P15538 3/20 0.48
CYP19A1 P11511 3/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
NFE2L2 Q16236 2/20 0.43
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 1/20 0.43
JUN P05412 1/20 0.43
NFKB1 P19838 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 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
SCHEMBL8911420 0.85 ALDH1A1 (0.62) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL3142532 0.83 CYP11B2 (0.68) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL27515192 0.80 MAPT (0.54) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL5780179 0.80 ALDH1A1 (0.53) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL28825475 0.79 CYP1A1 (0.52) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL8081818 0.76 ALDH1A1 (0.51) RAB9AALDH1A1CYP11B2CYP11B1NPC1
SCHEMBL11526331 0.75 ALDH1A1 (0.72) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL28517024 0.75 ALOX5 (0.50) RAB9AALDH1A1CYP11B2CYP11B1CYP19A1
SCHEMBL576415 0.75 NFE2L2 (0.71) RAB9AALDH1A1NPC1NFE2L2MAPT
SCHEMBL1798676 0.75 NFE2L2 (0.52) ALDH1A1NPC1NFE2L2MAPT

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 10 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
CN-101528690-A Isoindoline derivatives for the treatment of arrhythmias ASTRAZENECA AB (SE) 2009-09-09 CN 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
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 RAB9A 483/4885ALDH1A1 315/4885CYP11B2 72/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 RAB9A 899/4885ALDH1A1 310/4885CYP11B2 113/4885

“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.