SCHEMBL30416864

SCHEMBL30416864

COc1cc2cc(C(=O)C[C@H](C)C(=O)O)sc2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 1.00

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
SCHEMBL20022294 1.00 STING1 (1.00) STING1
SCHEMBL20022251 1.00 STING1 (1.00) STING1
SCHEMBL25015478 1.00 STING1 (1.00) STING1
SCHEMBL21422974 0.94 STING1 (0.88) STING1
SCHEMBL21422853 0.94 STING1 (0.88) STING1
SCHEMBL31496359 0.94 STING1 (0.88) STING1
SCHEMBL21405907 0.94 STING1 (0.88) STING1
SCHEMBL21406359 0.94 STING1 (0.88) STING1
SCHEMBL25015479 0.94 STING1 (0.88) STING1
SCHEMBL21405909 0.94 STING1 (0.88) 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
CN-111971277-B Benzothiophenes and related compounds as STING agonists 默沙东有限责任公司 2023-06-06 CN disclosed