SCHEMBL3756811

SCHEMBL3756811

Cc1ccc(CNC(=O)CF)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.65
LMNA P02545 3/20 0.65
MEN1 O00255 5/20 0.60
ALDH1A1 P00352 4/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.58
TDP1 Q9NUW8 1/20 0.57
POLB P06746 2/20 0.56
TP53 P04637 1/20 0.56
HPGD P15428 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
USP2 O75604 1/20 0.53

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
SCHEMBL27672365 0.82 TRPV1 (0.54) KMT2ALMNAALDH1A1RAB9ATP53
SCHEMBL13932527 0.82 KMT2A (0.83) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL27752775 0.82 TPSAB1 (0.50) KMT2ALMNAALDH1A1RAB9ATP53
SCHEMBL660986 0.82 KMT2A (0.62) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL12326826 0.82 KMT2A (0.62) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL28755070 0.81 HPGD (0.46) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL23564742 0.81 KMT2A (0.65) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL11731507 0.81 KMT2A (0.65) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL3756809 0.81 LMNA (0.49) KMT2ALMNAMEN1ALDH1A1RAB9A
SCHEMBL18235894 0.81 CA1 (0.62) KMT2ALMNAMEN1ALDH1A1NPC1

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 KMT2A 3483/4885LMNA 228/4885MEN1 538/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KMT2A 3979/4885LMNA 461/4885MEN1 2400/4885

“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.