SCHEMBL3750571

SCHEMBL3750571

O=C(NCCc1ccccc1)C1c2ccc(O)cc2C(=O)N1Cc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
TP53 P04637 2/20 0.54
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KCNA5 P22460 5/20 0.49
KCNH2 Q12809 2/20 0.49
KMT2A Q03164 1/20 0.47
MDM2 Q00987 1/20 0.46
POLB P06746 1/20 0.45
BRS3 P32247 1/20 0.43
PLAAT3 P53816 1/20 0.43
PLAAT5 Q96KN8 1/20 0.43
PLAAT2 Q9NWW9 1/20 0.43
PLAAT4 Q9UL19 1/20 0.43

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
SCHEMBL3751208 0.85 KMT2A (0.50) ALDH1A1TP53LMNASMN1; SMN2KCNA5
SCHEMBL3756760 0.84 KCNA5 (0.70) ALDH1A1TP53LMNASMN1; SMN2KCNA5
SCHEMBL3758129 0.83 ALDH1A1 (0.76) ALDH1A1TP53LMNASMN1; SMN2KCNA5
SCHEMBL3753733 0.81 ALDH1A1 (0.62) ALDH1A1TP53LMNASMN1; SMN2KCNA5
SCHEMBL3750606 0.81 ALDH1A1 (0.60) ALDH1A1TP53LMNASMN1; SMN2KCNH2
SCHEMBL3748464 0.81 PRMT5 (0.56) ALDH1A1KCNA5KCNH2POLB
SCHEMBL3754327 0.79 KCNA5 (0.66) KCNA5KCNH2
SCHEMBL3751659 0.77 P2RX7 (0.55) ALDH1A1TP53KCNA5
SCHEMBL3756944 0.76 PRMT5 (0.56) ALDH1A1TP53KCNA5KCNH2
SCHEMBL3756000 0.76 KCNA5 (0.67) ALDH1A1TP53LMNASMN1; SMN2KCNA5

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 315/4885TP53 3912/4885LMNA 228/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 ALDH1A1 310/4885TP53 3602/4885LMNA 461/4885

“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.