SCHEMBL29447351

SCHEMBL29447351

c1ccc(COCCN2CCCC2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 6/20 0.87
▸ HRH3 Q9Y5N1 2/20 0.61
▸ SLC6A3 Q01959 1/20 0.58
▸ HTT P42858 2/20 0.57
▸ SIGMAR1 Q99720 3/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ DRD1 P21728 1/20 0.54
▸ DRD4 P21917 1/20 0.54
▸ DRD5 P21918 1/20 0.54
▸ HRH1 P35367 1/20 0.54
▸ DRD3 P35462 1/20 0.54

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
SCHEMBL6393260 0.98 LTA4H (0.84) LTA4HHRH3SLC6A3HTTSIGMAR1
SCHEMBL22440218 0.93 LTA4H (0.77) LTA4HHRH3SLC6A3HTTSIGMAR1
SCHEMBL26981197 0.92 LTA4H (0.75) LTA4HHRH3SLC6A3HTTSIGMAR1
SCHEMBL19557301 0.92 LTA4H (0.75) LTA4HHRH3SLC6A3HTTSIGMAR1
SCHEMBL27540109 0.90 LTA4H (0.72) LTA4HHRH3HTTSIGMAR1NPC1
SCHEMBL31305362 0.89 LTA4H (0.71) LTA4HHRH3SLC6A3SIGMAR1RAB9A
SCHEMBL27533341 0.89 LTA4H (0.70) LTA4HHRH3HTTSIGMAR1NPC1
SCHEMBL13940618 0.87 LTA4H (0.68) LTA4HHRH3HTTSIGMAR1NPC1
SCHEMBL7388780 0.86 LTA4H (0.67) LTA4HHRH3SLC6A3HTTSIGMAR1
SCHEMBL2650781 0.84 LTA4H (0.65) LTA4HHRH3SLC6A3HTTSIGMAR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11299490-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2022-04-12 — — 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 (1 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-11299490-B2 Benzenesulfonamide compounds and their use as therapeutic agents SCN1A, SCN1B, SCN2B LTA4H 1555/4885HRH3 1685/4885SLC6A3 193/4885

“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.

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