SCHEMBL25844831

SCHEMBL25844831

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

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.35
TSHR P16473 4/20 0.35
PKM P14618 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SLC2A1 P11166 1/20 0.34
LMNA P02545 4/20 0.34
ALDH1A1 P00352 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
HTT P42858 2/20 0.34
MAPT P10636 1/20 0.34
FABP4 P15090 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL25845031 0.87 PKM (0.38) ELANETSHRPKMNPC1RAB9A
SCHEMBL25844800 0.83 SLC2A1 (0.33) ELANETSHRPKMNPC1RAB9A
SCHEMBL25844797 0.81 ELANE (0.46) ELANEPKMALDH1A1MAPTL3MBTL1
SCHEMBL25844996 0.80 PKM (0.35) ELANETSHRPKMNPC1RAB9A
SCHEMBL2605926 0.78 HSD17B10 (0.49) RAB9AALDH1A1HTTMAPTL3MBTL1
SCHEMBL25844834 0.77 GAA (0.32) ELANEALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL16020838 0.77 LMNA (0.33) ELANETSHRPKMSLC2A1LMNA
SCHEMBL22279486 0.75 CDC25B (0.49) ELANETSHRPKMNPC1RAB9A
SCHEMBL25845033 0.75 GAA (0.32) ELANEPKMALDH1A1SMN1; SMN2MAPT
SCHEMBL12308170 0.71 KDM4E (0.51) ELANETSHRLMNAALDH1A1HTT

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