SCHEMBL344751

SCHEMBL344751

NC(=O)c1coc(CO)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
CYP2C19 P33261 1/20 0.41
LMNA P02545 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
TSHR P16473 1/20 0.35
MC4R P32245 1/20 0.35
ADRA1A P35348 1/20 0.35
MC3R P41968 1/20 0.35
HDAC6 Q9UBN7 2/20 0.33
BMP1 P13497 1/20 0.33
FBP1 P09467 1/20 0.33
HRH3 Q9Y5N1 2/20 0.31
HTR2B P41595 1/20 0.31
SIRT6 Q8N6T7 1/20 0.31
PIM1 P11309 1/20 0.30

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
SCHEMBL15001323 0.84 ALDH1A1 (0.47) ALDH1A1CYP2C19LMNAADORA3TSHR
SCHEMBL1980837 0.82 ALDH1A1 (0.46) ALDH1A1CYP2C19LMNAADORA3TSHR
SCHEMBL19691270 0.82 ALDH1A1 (0.46) ALDH1A1LMNAHDAC6BMP1FBP1
SCHEMBL15145304 0.82 ALDH1A1 (0.46) ALDH1A1CYP2C19LMNAADORA3TSHR
SCHEMBL742811 0.82 CES1 (0.39) ALDH1A1LMNATSHRHDAC6FBP1
SCHEMBL1166830 0.80 FPR2 (0.42) ALDH1A1HDAC6HRH3
SCHEMBL14206713 0.79 ALDH1A1 (0.44) ALDH1A1LMNAHDAC6HRH3
SCHEMBL3129463 0.79 ALDH1A1 (0.44) ALDH1A1LMNAHDAC6BMP1FBP1
SCHEMBL27411713 0.78 ALDH1A1 (0.42) ALDH1A1LMNAFBP1HRH3SIRT6
Formic Acid SCHEMBL13268501 0.77 ALDH1A1 (0.41) ALDH1A1LMNAHDAC6BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP disclosed
US-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US disclosed
US-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2012-01-19 US disclosed
EP-2356108-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-08-17 EP disclosed
WO-2010055267-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-05-20 WO 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-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF INTS9, CDK8, SCN8A ALDH1A1 2486/4885CYP2C19 182/4885LMNA 3145/4885

“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.