SCHEMBL19287208

SCHEMBL19287208

CCC(=O)c1ccc(OCCC=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ MAPT P10636 4/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ HPGD P15428 1/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ GAA P10253 2/20 0.52
▸ ABCB1 P08183 1/20 0.50
▸ MMP1 P03956 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ HRH3 Q9Y5N1 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ PLK1 P53350 1/20 0.49
▸ HRH2 P25021 1/20 0.48
▸ HRH1 P35367 1/20 0.48

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
SCHEMBL19043385 0.87 L3MBTL1 (0.62) SMN1; SMN2MAPTNPC1L3MBTL1MMP1
SCHEMBL17129733 0.86 L3MBTL1 (0.62) SMN1; SMN2MAPTRAB9ANPC1HPGD
SCHEMBL14226876 0.83 L3MBTL1 (0.70) MAPTRAB9AHPGDL3MBTL1GAA
SCHEMBL19043386 0.83 MMP1 (0.47) MAPTNPC1L3MBTL1GAAMMP1
SCHEMBL19043134 0.83 HRH2 (0.50) SMN1; SMN2MAPTL3MBTL1GAAMMP1
SCHEMBL10040898 0.82 L3MBTL1 (0.69) SMN1; SMN2MAPTRAB9ANPC1HPGD
SCHEMBL8172219 0.82 L3MBTL1 (0.74) SMN1; SMN2MAPTRAB9ANPC1HPGD
SCHEMBL20278587 0.82 GAA (0.67) SMN1; SMN2MAPTRAB9ANPC1HPGD
SCHEMBL28258061 0.81 ALDH1A1 (0.65) L3MBTL1ALDH1A1HTT
SCHEMBL14574019 0.81 NR1I2 (0.68) SMN1; SMN2MAPTRAB9ANPC1HPGD

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
EP-2594563-B1 2-acylaminopropanol-type glucosylceramide synthase inhibitors GENZYME CORP (US) 2018-07-18 — — EP disclosed
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

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 SMN1; SMN2 964/4885MAPT 2401/4885RAB9A 2280/4885

“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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