SCHEMBL25845007

SCHEMBL25845007

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

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.34
EPAS1 Q99814 3/20 0.32
ABL1 P00519 1/20 0.32
RIN1 Q13671 1/20 0.32
ELANE P08246 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL25845008 0.95 CA2 (0.33) CA2EPAS1ABL1RIN1ELANE
SCHEMBL25844808 0.89 CA2 (0.34) CA2EPAS1ABL1RIN1ELANE
SCHEMBL25845020 0.88 CA2 (0.32) CA2ELANE
SCHEMBL25844999 0.87 CA2 (0.32) CA2ELANE
SCHEMBL25845012 0.87 EPAS1 (0.35) CA2EPAS1MEN1KMT2A
SCHEMBL25845005 0.86
SCHEMBL25844811 0.85 CA2 (0.33) CA2EPAS1ABL1RIN1ELANE
SCHEMBL25844995 0.85 ELANE (0.40) ELANE
SCHEMBL25845023 0.83 ALDH3A1 (0.39) EPAS1ALDH1A1MEN1KMT2A
SCHEMBL25845003 0.79

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