SCHEMBL20023078

SCHEMBL20023078

Cc1noc(C)c1COc1cccc(C(=O)C(=O)OCc2ccccc2)c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
ALDH1A1 P00352 7/20 0.60
LMNA P02545 4/20 0.60
HPGD P15428 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
TSHR P16473 5/20 0.59
ATM Q13315 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
POLB P06746 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
ALOX15 P16050 2/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
HSD17B10 Q99714 1/20 0.55
PKM P14618 1/20 0.54
GAA P10253 1/20 0.54
USP2 O75604 1/20 0.54
RAC1 P63000 1/20 0.52

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
SCHEMBL30165933 0.83 GAA (0.72) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL28588209 0.83 GAA (0.72) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL31217534 0.80 ALDH1A1 (0.70) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL28915156 0.79 ALDH1A1 (0.72) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL17978704 0.78 MAOB (0.66) ALDH1A1SMN1; SMN2KMT2AMEN1PKM
SCHEMBL38660523 0.77 LMNA (0.78) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL32676009 0.76 ALDH1A1 (0.70) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL19002336 0.75 ALDH1A1 (0.56) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL17109040 0.73 ALDH1A1 (0.80) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL30835886 0.73 ALDH1A1 (0.61) MAPTALDH1A1LMNAHPGDSMN1; SMN2

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 2 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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors GENZYME CORPORATION 2018-04-05 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 MAPT 2401/4885ALDH1A1 961/4885LMNA 1311/4885

“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.