SCHEMBL3756809

SCHEMBL3756809

[CH2]c1ccc(CNC(=O)CF)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
TPSAB1 Q15661 4/20 0.48
HTT P42858 1/20 0.46
HPGD P15428 3/20 0.45
ALDH1A1 P00352 2/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.43
PTPRZ1 P23471 1/20 0.42
PRSS1 P07477 1/20 0.42
MEN1 O00255 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
SCHEMBL27752775 0.82 TPSAB1 (0.50) LMNATPSAB1HTTHPGDALDH1A1
SCHEMBL27672365 0.82 TRPV1 (0.54) LMNATPSAB1HTTHPGDALDH1A1
SCHEMBL29375630 0.81 L3MBTL1 (0.62) LMNATPSAB1HTTHPGDALDH1A1
SCHEMBL3756811 0.81 KMT2A (0.65) LMNAHPGDALDH1A1RAB9AKMT2A
SCHEMBL15667990 0.80 GAA (0.66) LMNAHTTHPGDALDH1A1RAB9A
SCHEMBL3738945 0.79 NPC1 (0.50) LMNATPSAB1HTTHPGDALDH1A1
SCHEMBL28755070 0.78 HPGD (0.46) LMNATPSAB1HTTHPGDALDH1A1
SCHEMBL27672313 0.77 NPC1 (0.65) LMNAHPGDALDH1A1RAB9AKMT2A
SCHEMBL3751727 0.76 KMT2A (0.63) ALDH1A1RAB9AKMT2AGAA
SCHEMBL3755673 0.76 KMT2A (0.41) LMNATPSAB1HPGDKMT2AGAA

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 LMNA 228/4885TPSAB1 3277/4885HTT 3361/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 LMNA 461/4885TPSAB1 2924/4885HTT 3086/4885

“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.