SCHEMBL28514112

SCHEMBL28514112

COCCCOc1cc(C(N)=O)cc2nc(N)n(CCCOC(N)=O)c12

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 18/20 0.49
▸ ADORA2A P29274 2/20 0.41

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
SCHEMBL28515124 0.89 STING1 (0.47) STING1
SCHEMBL28508303 0.86 STING1 (0.47) STING1
SCHEMBL22121402 0.84 STING1 (0.54) STING1
SCHEMBL28522082 0.84 STING1 (0.56) STING1
SCHEMBL19437494 0.80 STING1 (0.49) STING1
SCHEMBL19451814 0.79 STING1 (0.48) STING1
SCHEMBL19451779 0.79 STING1 (0.48) STING1
SCHEMBL28614903 0.79 STING1 (0.48) STING1
SCHEMBL19437481 0.77 STING1 (0.59) STING1
SCHEMBL22135036 0.77 STING1 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112279835-B Aromatic ring or aromatic heterocyclic imidazole compound, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2022-07-22 — — CN disclosed
CN-112279835-A Aromatic ring or aromatic heterocyclic imidazole compound, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2021-01-29 — — CN disclosed
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