SCHEMBL3747565

SCHEMBL3747565

CCCCNC(=O)C1c2ccccc2C(=O)N1Cc1ccccc1Oc1ccc(F)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.63
ALDH1A1 P00352 3/20 0.55
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KCNH2 Q12809 2/20 0.54
THRB P10828 1/20 0.51
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL3751701 0.94 ALDH1A1 (0.57) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3745324 0.84 KCNA5 (0.54) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3750361 0.84 ALDH1A1 (0.53) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3752692 0.81 KCNA5 (0.69) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3751848 0.79 KCNA5 (0.69) KCNA5ALDH1A1KCNH2TP53
SCHEMBL3750037 0.79 KCNA5 (0.56) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3755363 0.78 KCNA5 (0.65) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL3758124 0.77 KCNA5 (1.00) KCNA5ALDH1A1SMN1; SMN2KCNH2TP53
SCHEMBL3755348 0.77 GAA (0.68) KCNA5ALDH1A1SMN1; SMN2KCNH2TP53
SCHEMBL3753987 0.77 SCN9A (0.54) KCNA5ALDH1A1LMNASMN1; SMN2KCNH2

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 6 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
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 KCNA5 69/4885ALDH1A1 315/4885LMNA 228/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 KCNA5 72/4885ALDH1A1 310/4885LMNA 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.