SCHEMBL28829463

SCHEMBL28829463

CC(=O)CC(=O)OC(=O)C1=CC=CNC=C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33

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
SCHEMBL25195357 0.72 CA12 (0.34)
Hydrochloric Acid SCHEMBL27029865 0.71 CA12 (0.33)
SCHEMBL27293804 0.69
SCHEMBL25201264 0.68 CA1 (0.32) GAA
Hydrochloric Acid SCHEMBL28600502 0.65
Water SCHEMBL27651933 0.65
Benzene SCHEMBL27686426 0.65
Water SCHEMBL27527439 0.64
Hydrochloric Acid SCHEMBL27880977 0.64
SCHEMBL449524 0.63 MGAM (0.67) MGAMGAASIMGAM2

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-105669552-A Substituted benzoazepines as TOLL-like receptor modulators 文蒂雷克斯药品公司 2016-06-15 CN disclosed