SCHEMBL25844800

SCHEMBL25844800

CC(I)C(=O)Oc1ccc(OC(=O)C(F)(F)S(=O)(=O)O)c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.33
TSHR P16473 2/20 0.33
PKM P14618 2/20 0.33
NCEH1 Q6PIU2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 2/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL25844834 0.95 GAA (0.32) MEN1KMT2AELANEALDH1A1MAPT
SCHEMBL25844996 0.87 PKM (0.35) SLC2A1TSHRPKMNCEH1NPC1
SCHEMBL25844831 0.83 ELANE (0.35) SLC2A1TSHRPKMNPC1RAB9A
SCHEMBL25845033 0.82 GAA (0.32) PKMMEN1KMT2AELANEALDH1A1
SCHEMBL25844803 0.82
SCHEMBL25844820 0.82
SCHEMBL25845031 0.81 PKM (0.38) SLC2A1TSHRPKMNPC1RAB9A
SCHEMBL25844806 0.81
SCHEMBL25844798 0.80 ELANE (0.40) PKML3MBTL1ELANEMAPT
SCHEMBL25844818 0.79 CA2 (0.32) TSHRL3MBTL1ELANE

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