SCHEMBL25845012

SCHEMBL25845012

CC(Br)C(=O)Oc1ccc(OC(=O)C(F)(F)S(=O)(=O)O)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.35
SCN9A Q15858 5/20 0.33
RORC P51449 2/20 0.33
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARA Q07869 5/20 0.32
FFAR1 O14842 1/20 0.32
CA2 P00918 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
KCNH2 Q12809 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
PPARD Q03181 1/20 0.31

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
SCHEMBL25844814 0.88 SCN9A (0.33) EPAS1SCN9ARORCPPARAFFAR1
SCHEMBL25845020 0.87 CA2 (0.32) TSHRCA2
SCHEMBL25845007 0.87 CA2 (0.34) EPAS1MEN1KMT2ACA2
SCHEMBL25844999 0.86 CA2 (0.32) CA2
SCHEMBL25844995 0.84 ELANE (0.40)
SCHEMBL25845008 0.82 CA2 (0.33) EPAS1CA2
SCHEMBL25845023 0.82 ALDH3A1 (0.39) EPAS1MEN1KMT2A
SCHEMBL25845016 0.81 MEN1 (0.30) MEN1TSHRKMT2A
SCHEMBL25844996 0.78 PKM (0.35) MEN1TSHRKMT2A
SCHEMBL25845005 0.78

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