SCHEMBL19043386

SCHEMBL19043386

CC(C)(C)CC(=O)c1ccc(OCCC=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 2/20 0.47
▸ MAPT P10636 2/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ GAA P10253 1/20 0.42
▸ PLK1 P53350 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ PPARA Q07869 2/20 0.40
▸ PKM P14618 1/20 0.39
▸ THRA P10827 1/20 0.39

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
SCHEMBL22900385 0.83 L3MBTL1 (0.66) MMP1MAPTL3MBTL1PLK1ALDH1A1
SCHEMBL19287208 0.83 SMN1; SMN2 (0.54) MMP1MAPTL3MBTL1GAAPLK1
SCHEMBL19043385 0.80 L3MBTL1 (0.62) MMP1MAPTL3MBTL1PLK1ALDH1A1
SCHEMBL14226876 0.79 L3MBTL1 (0.70) MAPTL3MBTL1GAAALDH1A1
SCHEMBL19043134 0.79 HRH2 (0.50) MMP1MAPTL3MBTL1GAAPLK1
SCHEMBL15788223 0.78 ALDH1A1 (0.56) MAPTL3MBTL1GAAPLK1ALDH1A1
SCHEMBL28258061 0.77 ALDH1A1 (0.65) L3MBTL1ALDH1A1PKM
SCHEMBL2552642 0.76 PARP10 (0.64) ALDH1A1
SCHEMBL7902328 0.75 ALDH1A1 (0.62) MMP1MAPTL3MBTL1GAAALDH1A1
SCHEMBL28259696 0.74 MAPT (0.51) MAPTL3MBTL1GAAALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors GENZYME CORPORATION 2018-04-05 — — US disclosed
US-9745294-B2 2-acylaminopropoanol-type glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2017-08-29 — — US disclosed
US-9744153-B2 2-acylaminopropoanol-type glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2017-08-29 — — US disclosed
EP-2320886-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORP (US) 2017-06-28 — — EP 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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors ASAH2, GBA1, GAA MMP1 687/4885MAPT 2401/4885L3MBTL1 3762/4885

“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.

Send feedback