SCHEMBL25015477

SCHEMBL25015477

CC(CC(=O)c1cc2cc3c(cc2s1)OCO3)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.66

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
SCHEMBL21422846 0.90 STING1 (0.63) STING1
SCHEMBL21422854 0.90 STING1 (0.63) STING1
SCHEMBL13659600 0.81 NPC1 (0.48) STING1
SCHEMBL25695688 0.80 STING1 (0.51) STING1
SCHEMBL21530385 0.80 STING1 (1.00) STING1
SCHEMBL21405926 0.80 STING1 (0.76) STING1
SCHEMBL30417447 0.80 STING1 (0.76) STING1
SCHEMBL21405925 0.80 STING1 (0.76) STING1
SCHEMBL21439033 0.80 STING1 (0.76) STING1
SCHEMBL20022290 0.80 STING1 (1.00) STING1

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
WO-2023005267-A1 BENZO [B] SELENOPHENE STING REGULATING AGENT, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 中国药科大学 2023-02-02 WO disclosed