SCHEMBL2529183

SCHEMBL2529183

CS(=O)(=O)OC(=O)C1CCCc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
PIN1 Q13526 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HTT P42858 2/20 0.42
XBP1 P17861 1/20 0.42
IDO1 P14902 2/20 0.42
CYP1A2 P05177 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TAS1R3 Q7RTX0 3/20 0.41
TAS1R1 Q7RTX1 3/20 0.41
TAS1R2 Q8TE23 1/20 0.41

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
SCHEMBL769134 0.82 KMT2A (0.51) PIN1ALDH1A1HTTMEN1KMT2A
SCHEMBL29484101 0.82 KMT2A (0.51) PIN1ALDH1A1HTTMEN1KMT2A
SCHEMBL651410 0.82 HTT (0.51) LMNAPIN1ALDH1A1HTTIDO1
SCHEMBL2529181 0.79 LMNA (0.51) LMNAALDH1A1HTTCYP1A2MEN1
SCHEMBL10708816 0.79 LMNA (0.43) LMNAPIN1ALDH1A1HTTXBP1
SCHEMBL2115724 0.78 ALDH1A1 (0.51) LMNAPIN1ALDH1A1HTTXBP1
SCHEMBL2607721 0.78 ALDH1A1 (0.45) PIN1ALDH1A1HTTXBP1IDO1
SCHEMBL31262315 0.77 HTT (0.49) PIN1ALDH1A1HTTXBP1MEN1
SCHEMBL2448483 0.77 HTT (0.49) PIN1ALDH1A1HTTXBP1MEN1
SCHEMBL10816187 0.77 HTT (0.47) PIN1ALDH1A1HTTIDO1MEN1

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
US-20110250238-A1 SYSTEM FOR THE COLON DELIVERY OF DRUGS SUBJECT TO ENZYME DEGRADATION AND/OR POORLY ABSORBED IN THE GASTROINTESTINAL TRACT SANGALLI MARIA EDVIGE 2011-10-13 US disclosed
EP-1965828-A2 PHARMACEUTICAL FORMULATION FOR INCREASED EPITHELIAL PERMEABILITY OF GLUCOSE-REGULATING PEPTIDE Nastech Pharmaceutical Company Inc. (US) 2008-09-10 EP disclosed
WO-2007146448-A1 PHARMACEUTICAL FORMULATIONS OF GLP-1 DERIVATIVES NASTECH PHARMACEUTICAL COMPANY INC. (US) 2007-12-21 WO disclosed
WO-2007065156-A2 PHARMACEUTICAL FORMULATION FOR INCREASED EPITHELIAL PERMEABILITY OF GLUCOSE-REGULATING PEPTIDE NASTECH PHARMACEUTICAL COMPANY INC. (US) 2007-06-07 WO disclosed