SCHEMBL9561618

SCHEMBL9561618

COC(=O)C(F)(F)C(F)(F)C(O)(F)C(F)=C(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL11509142 0.94 ALDH1A1 (0.33) ALDH1A1
SCHEMBL497763 0.78 DGAT1 (0.39) ALDH1A1
SCHEMBL517272 0.78 DGAT1 (0.39) ALDH1A1
SCHEMBL15297286 0.76 ALDH1A1 (0.38) ALDH1A1
SCHEMBL672362 0.75 THRB (0.40) ALDH1A1
SCHEMBL3082673 0.75 THRB (0.40) ALDH1A1
SCHEMBL11205420 0.75 THRB (0.40) ALDH1A1
SCHEMBL517251 0.75 THRB (0.40) ALDH1A1
SCHEMBL21496106 0.74
SCHEMBL11509081 0.74 CYP4F2 (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5239027-A Optical fibers HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-24 US disclosed
US-5187769-A Comonomers of fluorinated acrylates, deuterium-substituted fluoroacrylates forming core/cladding structure of optical fibers; high glass transition temperature HOECHST AKTIENGESELLSCHAFT (DE) 1993-02-16 US disclosed