SCHEMBL6521670

SCHEMBL6521670

CCOC(=O)C1CCN(S(=O)(=O)N2CCOCC2)CC1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
POLB P06746 3/20 0.65
TSHR P16473 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.56
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPK1 P28482 1/20 0.53
CYP2C19 P33261 1/20 0.53
PKM P14618 2/20 0.52
LMNA P02545 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HTT P42858 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPT P10636 2/20 0.50

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
SCHEMBL8211769 0.95 TSHR (0.71) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL7119341 0.81 MAPT (0.55) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL18039877 0.80 MAPT (0.54) ALDH1A1TSHRSMN1; SMN2LMNAMAPT
SCHEMBL561797 0.80 TP53 (0.67) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL3019223 0.80 ALDH1A1 (0.61) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL19123323 0.78 ALDH1A1 (0.59) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL21375730 0.78 ALDH1A1 (0.58) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL72855 0.77 MAPT (0.51) ALDH1A1POLBTSHRCYP3A4CYP2C19
SCHEMBL3183107 0.76 TSHR (1.00) ALDH1A1POLBTSHRSMN1; SMN2KMT2A
SCHEMBL6214130 0.76 ALDH1A1 (0.57) ALDH1A1POLBTSHRSMN1; SMN2KMT2A

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-2475644-B1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN LA ROCHE (CH) 2014-01-08 EP disclosed
US-8258158-B2 HSL inhibitors useful in the treatment of diabetes HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
EP-2475644-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. Hoffmann-La Roche AG (CH) 2012-07-18 EP disclosed
WO-2011029808-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-17 WO disclosed
US-20110065707-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN-LA ROCHE, INC. 2011-03-17 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-20110065707-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES LIPE, PNLIP, LPL ALDH1A1 721/4885POLB 4833/4885TSHR 854/4885

“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.