SCHEMBL16007089

SCHEMBL16007089

O=C(NC1(c2ccc(Br)cc2)CC1)OC1CCN2CCC1CC2

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 5/20 0.54
▸ BCHE P06276 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ NTMT1 Q9BV86 1/20 0.40
▸ CHRM3 P20309 5/20 0.39
▸ GAA P10253 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ CHRM2 P08172 3/20 0.37
▸ CHRM1 P11229 3/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CHRM4 P08173 2/20 0.36
▸ CHRM5 P08912 2/20 0.36

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
SCHEMBL12614734 0.92 CHRNA7 (0.66) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL16006990 0.92 CHRNA7 (0.66) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL16007093 0.85 CHRM3 (0.42) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL29384752 0.79 HRH3 (0.38) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL29386768 0.78 HRH3 (0.42) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL16007179 0.78 CHRNA7 (0.59) CHRNA7BCHEACHECHRM3GAA
SCHEMBL29387657 0.77 HRH3 (0.38) NTMT1
SCHEMBL16007046 0.77 CHRM3 (0.51) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL30745971 0.77 CHRM3 (0.51) CHRNA7BCHEACHENPC1RAB9A
SCHEMBL16007049 0.77 CHRM3 (0.51) CHRNA7BCHEACHENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3673906-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Genzyme Corporation (US) 2020-07-01 — — EP disclosed
US-20200048266-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORP (US) 2020-02-13 — — US disclosed
US-20160207933-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION 2016-07-21 — — US disclosed
US-9139580-B2 Glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2015-09-22 — — US disclosed
US-9126993-B2 Glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2015-09-08 — — US disclosed
US-20140371460-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION 2014-12-18 — — US disclosed
US-20140255381-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2014-09-11 — — 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 (4 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-20200048266-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA CHRNA7 4678/4885BCHE 905/4885ACHE 3823/4885
US-20160207933-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA CHRNA7 4670/4885BCHE 869/4885ACHE 3743/4885
US-20140371460-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA CHRNA7 4670/4885BCHE 869/4885ACHE 3743/4885
US-20140255381-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA CHRNA7 4670/4885BCHE 869/4885ACHE 3743/4885

“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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