SCHEMBL1749166

SCHEMBL1749166

CC(=O)N(C)[C@@H]1CNC[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 9/20 0.44
FUCA1 P04066 4/20 0.44
GLA P06280 2/20 0.44
GAA P10253 2/20 0.44
GLB1 P16278 2/20 0.44
MAN1B1 Q9UKM7 1/20 0.42
PYGL P06737 1/20 0.34
GBA2 Q9HCG7 1/20 0.34

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
SCHEMBL1749164 1.00 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL27644253 1.00 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL1749165 1.00 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL2304547 0.83 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL2304542 0.83 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL2304538 0.83 GBA1 (0.44) GBA1FUCA1GLAGAAGLB1
SCHEMBL10374455 0.81 FUCA1 (0.40) FUCA1
SCHEMBL16819055 0.76 FUCA1 (0.41) GBA1FUCA1GLAGAAGLB1
SCHEMBL16819065 0.76 FUCA1 (0.41) GBA1FUCA1GLAGAAGLB1
SCHEMBL2244209 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968550-B2 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
CN-100506792-C Substituted N-aryl heterocycles, method for the production thereof and their use as medicaments AVENTIS PHARMA GMBH (DE) 2009-07-01 CN disclosed
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US disclosed
US-7223788-B2 therapy for eating disorders, anorexigenic agents, antidiabetic agents, reducing weight in mammals, circadian rhythm disease, psychological disorders SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-29 US disclosed
CN-1774418-A Substituted N-arylheterocycles, method for production and use thereof as medicaments AVENTIS PHARMA GMBH (DE) 2006-05-17 CN disclosed
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 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 (2 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 GBA1 1832/4885FUCA1 2220/4885GLA 2872/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 GBA1 2105/4885FUCA1 2702/4885GLA 2866/4885

“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.