SCHEMBL717201

SCHEMBL717201

C=C(C)C(=O)OC(C)NCCCS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.33
EPHX2 P34913 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
SCHEMBL9274701 0.83 TSHR (0.46) TSHRALDH1A1
SCHEMBL7743447 0.82 THRB (0.39) TSHR
SCHEMBL29044528 0.81 TSHR (0.49) TSHRALDH1A1
SCHEMBL10610014 0.81 TSHR (0.49) TSHRALDH1A1
SCHEMBL9279513 0.81 TSHR (0.49) TSHRALDH1A1
SCHEMBL8052192 0.81 TSHR (0.49) TSHRALDH1A1
SCHEMBL331326 0.81 TSHR (0.43) TSHRALDH1A1
Hydrochloric Acid SCHEMBL725775 0.80 TSHR (0.47) TSHRALDH1A1
Bromide SCHEMBL28897725 0.80 TSHR (0.47) TSHRALDH1A1
Hydrochloric Acid SCHEMBL29131465 0.80 TSHR (0.47) TSHRALDH1A1

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
US-20150202575-A1 COMPOSITE MEMBRANES AND METHODS OF PREPARATION THEREOF GLOBALFOUNDRIES U.S. INC. 2015-07-23 US disclosed
US-8709536-B2 Composite filtration membranes and methods of preparation thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-04-29 US disclosed
US-20120048799-A1 COMPOSITE FILTRATION MEMBRANES AND METHODS OF PREPARATION THEREOF INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-01 US disclosed
EP-1039968-A1 POLYBETAINE STABILIZED PLATINUM NANOPARTICLES, METHOD FOR THE PRODUCTION THEREOF AND UTILIZATION FOR FUEL-CELL CATALYSTS Axiva GmbH (DE) 2000-10-04 EP disclosed
WO-1999029423-A1 POLYBETAINE STABILIZED PLATINUM NANOPARTICLES, METHOD FOR THE PRODUCTION THEREOF AND UTILIZATION FOR FUEL-CELL CATALYSTS AXIVA GMBH (DE) 1999-06-17 WO disclosed