SCHEMBL25844834

SCHEMBL25844834

CC(I)C(=O)Oc1cccc2c(OC(=O)C(F)(F)S(=O)(=O)O)cccc12

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ESR1 P03372 6/20 0.32
ESR2 Q92731 6/20 0.32
HSD17B10 Q99714 2/20 0.31
PGR P06401 1/20 0.31
PTGS1 P23219 1/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
JAK2 O60674 1/20 0.31
USP2 O75604 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
POLB P06746 1/20 0.30
ELANE P08246 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
SCHEMBL25844800 0.95 SLC2A1 (0.33) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL25845033 0.87 GAA (0.32) GAAALDH1A1SMN1; SMN2ESR1ESR2
SCHEMBL25844996 0.82 PKM (0.35) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL25844803 0.82
SCHEMBL25844820 0.82
SCHEMBL25844806 0.81
SCHEMBL25844798 0.80 ELANE (0.40) MAPTPOLBELANE
SCHEMBL2605926 0.78 HSD17B10 (0.49) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL25844831 0.77 ELANE (0.35) GAAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL25845031 0.76 PKM (0.38) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11709426-B2 Resist composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-07-25 US disclosed