SCHEMBL3864233

SCHEMBL3864233

O=C(O)/C=C(\F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 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
SCHEMBL3864237 1.00 THRB (0.41) THRB
SCHEMBL3859756 0.93 THRB (0.50) THRB
SCHEMBL3859760 0.93 THRB (0.50) THRB
SCHEMBL3863624 0.91 THRB (0.54) THRB
SCHEMBL3863628 0.91 THRB (0.54) THRB
SCHEMBL3861684 0.91 THRB (0.54) THRB
SCHEMBL3864738 0.91 THRB (0.54) THRB
SCHEMBL3864741 0.91 THRB (0.54) THRB
SCHEMBL3861683 0.91 THRB (0.54) THRB
SCHEMBL30979236 0.91 THRB (0.54) THRB

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-7595396-B2 Process for preparing polyisocyanates containing iminooxadiazinedione groups BAYER MATERIALSCIENCE AG (DE) 2009-09-29 US claimed
EP-1645577-B1 Process for preparing polyisocyanates having iminoooxadiazinedione groups BAYER MATERIALSCIENCE AG (DE) 2008-08-20 EP claimed
US-20060079694-A1 Process for preparing polyisocyanates containing iminooxadiazinedione groups BAYER MATERIALSCIENCE AG 2006-04-13 US claimed
US-7595396-B2 Process for preparing polyisocyanates containing iminooxadiazinedione groups BAYER MATERIALSCIENCE AG (DE) 2009-09-29 US disclosed
US-20060079694-A1 Process for preparing polyisocyanates containing iminooxadiazinedione groups BAYER MATERIALSCIENCE AG 2006-04-13 US disclosed