SCHEMBL5872092

SCHEMBL5872092

C=C(C)C(=O)OC(C)(NS(=O)(=O)C(F)(F)C(F)(F)F)NS(=O)(=O)C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL2632786 0.78 TSHR (0.35) ALDH1A1
SCHEMBL20117645 0.77 ALDH1A1 (0.38) ALDH1A1
SCHEMBL1778771 0.74 CA1 (0.42) ALDH1A1
SCHEMBL3820636 0.73 CA2 (0.44) ALDH1A1
SCHEMBL11862226 0.73 CA2 (0.44) ALDH1A1
SCHEMBL3814152 0.72 CA2 (0.42) ALDH1A1
SCHEMBL8664101 0.72 CA2 (0.42) ALDH1A1
SCHEMBL10063505 0.71 TSHR (0.37) ALDH1A1
SCHEMBL15836504 0.70 ALDH1A1 (0.34) ALDH1A1
SCHEMBL2504864 0.69 ALDH1A1 (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098282-B2 Fluorosulfone-silicone hydrogel, RGP contact lenses, optical medical devices and compositions thereof NOVICKY NICK 2006-08-29 US disclosed
US-20050176907-A1 Fluorosulfone-silicone hydrogel, RGP contact lenses, optical medical devices and compositions thereof NOVICKY NICK (CA) 2005-08-11 US disclosed
EP-1455201-A1 Fluorosulfone-silicone hydrogel RGP contact lenses, optical medical devices and compositions thereof Novicky, Nick N. (CA) 2004-09-08 EP disclosed