SCHEMBL6216639

SCHEMBL6216639

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

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
AKR1C3 P42330 1/20 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
SCHEMBL225194 1.00 PTGS1 (0.32) PTGS1AKR1C3
SCHEMBL1416411 0.86 THRB (0.34) PTGS1AKR1C3
SCHEMBL3319389 0.84 THRB (0.38)
SCHEMBL345299 0.83 PTGS1 (0.31) PTGS1AKR1C3
SCHEMBL161691 0.83 PTGS1 (0.31) PTGS1AKR1C3
SCHEMBL2785405 0.82 THRB (0.41)
SCHEMBL534526 0.82 THRB (0.41)
SCHEMBL7004102 0.82 THRB (0.41)
SCHEMBL22204284 0.82 THRB (0.41)
SCHEMBL15754626 0.82 THRB (0.41)

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
EP-0338656-B1 Polymeric silicone-based materials with high oxygen permeability BAUSCH & LOMB (US) 1994-03-02 EP claimed
EP-1510197-B1 Dental coating material IVOCLAR VIVADENT AG (LI) 2016-03-09 EP disclosed
EP-1510197-A1 Dental coating material Firma Ivoclar Vivadent AG (LI) 2005-03-02 EP disclosed
EP-0338656-B1 Polymeric silicone-based materials with high oxygen permeability BAUSCH & LOMB (US) 1994-03-02 EP disclosed