SCHEMBL443593

SCHEMBL443593

O=C1OC(=O)c2c1cccc2C(CF)(c1cccc2c1C(=O)OC2=O)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TYMS P04818 2/20 0.35
CES1 P23141 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
SCHEMBL544762 0.80 ALOX15 (0.41) ALOX15TDP1TYMSCES1
SCHEMBL11729711 0.79 ALOX15 (0.44) ALOX15TDP1TYMSCES1
SCHEMBL11887459 0.77 ALOX15 (0.39) ALOX15TDP1TYMSCES1
SCHEMBL8597036 0.77 ALOX15 (0.39) ALOX15TDP1TYMSCES1
SCHEMBL28252490 0.74 ALOX15 (0.36) ALOX15TDP1TYMSCES1
SCHEMBL12475740 0.73 TDP1 (0.39) ALOX15TDP1TYMSCES1
SCHEMBL434702 0.72 ALOX15 (0.44) ALOX15TDP1TYMSCES1
SCHEMBL11726146 0.72 ALOX15 (0.44) ALOX15TDP1TYMSCES1
SCHEMBL7074292 0.72 TDP1 (0.44) ALOX15TDP1TYMS
SCHEMBL29254151 0.71 ALOX15 (0.45) ALOX15TDP1TYMSCES1

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-8735040-B2 Toner, developer, and image forming apparatus RICOH COMPANY, LTD. (JP) 2014-05-27 US disclosed
US-20130171550-A1 TONER, DEVELOPER, AND IMAGE FORMING APPARATUS RICOH COMPANY, LTD. (JP) 2013-07-04 US disclosed
US-20120065357-A1 RESIN FOR USE IN TONER, AND TONER AND DEVELOPER USING THE RESIN RICOH COMPANY, LTD. (JP) 2012-03-15 US disclosed