SCHEMBL16240339

SCHEMBL16240339

C=C=N.CC(COC(=O)O)OC(=O)O.O=C(O)OCCOC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32

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
SCHEMBL16240331 0.95 TSHR (0.34) TSHR
SCHEMBL1071020 0.89 TSHR (0.33) TSHR
Bicarbonate SCHEMBL8152425 0.87 TSHR (0.34) TSHR
Acetonitrile SCHEMBL16738052 0.84
Ethylene SCHEMBL498968 0.83 TSHR (0.39) TSHR
SCHEMBL15308 0.83 TSHR (0.37) TSHR
SCHEMBL15053822 0.83 TSHR (0.37) TSHR
SCHEMBL8727210 0.83 TSHR (0.37) TSHR
SCHEMBL748244 0.83 TSHR (0.37) TSHR
SCHEMBL1628670 0.82 MTNR1A (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140340729-A1 REFLECTIVE DIMMING ELECTROCHROMIC ELEMENT WITH NON-WATER BASED HYDROGEN ION CONDUCTIVE ELECTROLYTE LAYER INSERTED THEREIN, AND DIMMING ELEMENT USING THE SAME NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2014-11-20 US disclosed