SCHEMBL3756446

SCHEMBL3756446

CS(=O)(=O)c1ccc(CNC(=O)C2c3cc(Cl)ccc3C(=O)N2C(c2ccccc2)c2ccccc2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.45
KCNA5 P22460 2/20 0.42
KIT P10721 2/20 0.41
ELANE P08246 2/20 0.40
EPHX2 P34913 2/20 0.39
POLB P06746 1/20 0.38
F2 P00734 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
SCHEMBL3756768 0.92 P2RX7 (0.53) P2RX7KCNA5EPHX2
SCHEMBL3752040 0.91 KCNA5 (0.52) P2RX7KCNA5ELANE
SCHEMBL3751209 0.87 KCNA5 (0.52) P2RX7KCNA5ELANE
SCHEMBL3758057 0.84 P2RX7 (0.55) P2RX7KCNA5EPHX2
SCHEMBL3748014 0.81 P2RX7 (0.48) P2RX7KCNA5F2
SCHEMBL3755647 0.80 KCNA5 (0.61) P2RX7KCNA5
SCHEMBL3752066 0.80 KCNA5 (0.64) P2RX7KCNA5
SCHEMBL3750444 0.79 KCNA5 (0.48) P2RX7KCNA5
SCHEMBL3748265 0.78 P2RX7 (0.56) P2RX7KCNA5
SCHEMBL3751379 0.78 KCNA5 (0.54) P2RX7KCNA5POLB

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 P2RX7 1839/4885KCNA5 69/4885KIT 4585/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 P2RX7 1138/4885KCNA5 72/4885KIT 4129/4885

“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.