SCHEMBL17474445

SCHEMBL17474445

CC(=O)c1[c]ccc(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.34
CES1 P23141 2/20 0.34
BCHE P06276 1/20 0.33
HDAC4 P56524 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAOB P27338 1/20 0.30

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
SCHEMBL8364149 0.71 CA5A (0.32)
SCHEMBL5974232 0.68 THRB (0.37) ALDH1A1SMN1; SMN2
SCHEMBL15637260 0.67 CA1 (0.38) CES2CES1BCHEALDH1A1SMN1; SMN2
SCHEMBL17474448 0.67 SMN1; SMN2 (0.34) CES2CES1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL455383 0.66
SCHEMBL6101159 0.65 KEAP1 (0.32)
SCHEMBL3019334 0.65 DGAT1 (0.32)
SCHEMBL78405 0.64
SCHEMBL30313234 0.64 CES2 (0.46) CES2CES1BCHEALDH1A1MAPK1
SCHEMBL1994723 0.64 CES2 (0.46) CES2CES1BCHEALDH1A1MAPK1

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-10023827-B2 Cleaning composition for semiconductor substrate and cleaning method JSR CORPORATION (JP) 2018-07-17 US disclosed
US-20170240851-A1 CLEANING COMPOSITION FOR SEMICONDUCTOR SUBSTRATE AND CLEANING METHOD JSR CORPORATION (JP) 2017-08-24 US disclosed
US-20160032227-A1 CLEANING COMPOSITION FOR SEMICONDUCTOR SUBSTRATE AND CLEANING METHOD JSR CORPORATION (JP) 2016-02-04 US disclosed