SCHEMBL30891724

SCHEMBL30891724

CC(C)(C)OC(=O)c1cccc(-c2cc(Cl)ccc2OCCBr)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EIF4EBP1 Q13541 16/20 0.47
CYP2C9 P11712 1/20 0.46
PTGER1 P34995 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.44
SLC6A9 P48067 1/20 0.44

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
SCHEMBL29214612 1.00 EIF4EBP1 (0.47) EIF4EBP1CYP2C9PTGER1PTGDR2SLC6A9
SCHEMBL22866924 0.86 EIF4EBP1 (0.45) EIF4EBP1CYP2C9PTGER1PTGDR2SLC6A9
SCHEMBL29661889 0.86 EIF4EBP1 (0.45) EIF4EBP1CYP2C9PTGER1PTGDR2SLC6A9
SCHEMBL30850464 0.86 EIF4EBP1 (0.48) EIF4EBP1CYP2C9PTGER1PTGDR2
SCHEMBL22866872 0.81 SLC6A9 (0.43) EIF4EBP1CYP2C9PTGER1SLC6A9
SCHEMBL22866930 0.79 SLC7A5 (0.41) CYP2C9PTGER1
SCHEMBL29560131 0.75 XPO1 (0.41) SLC6A9
SCHEMBL12147621 0.74 PTGDR2 (0.48) EIF4EBP1CYP2C9PTGER1PTGDR2SLC6A9
SCHEMBL11617727 0.74 PTGDR2 (0.61) EIF4EBP1CYP2C9PTGER1PTGDR2SLC6A9
SCHEMBL22866680 0.74 EIF4EBP1 (0.40) EIF4EBP1CYP2C9PTGER1PTGDR2

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
CN-114269756-B 4-Oxo-3, 4-dihydropyrido [3,4-D ] pyrimidine compounds that inhibit EIF4E 效应疗法股份有限公司 2024-05-14 CN disclosed