SCHEMBL29867877

SCHEMBL29867877

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1CCCCNC(=O)c1ccn[nH]1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 20/20 0.83
▸ TBK1 Q9UHD2 1/20 0.77

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
SCHEMBL21628329 0.91 STING1 (1.00) STING1TBK1
SCHEMBL19436555 0.88 STING1 (0.92) STING1TBK1
SCHEMBL29868127 0.88 STING1 (1.00) STING1TBK1
SCHEMBL29867968 0.88 STING1 (0.90) STING1TBK1
SCHEMBL29526123 0.87 STING1 (1.00) STING1TBK1
SCHEMBL19451739 0.87 STING1 (1.00) STING1TBK1
SCHEMBL29867985 0.87 STING1 (1.00) STING1TBK1
SCHEMBL29868199 0.86 STING1 (1.00) STING1TBK1
SCHEMBL19449052 0.85 STING1 (0.86) STING1TBK1
SCHEMBL29868673 0.85 STING1 (0.84) STING1TBK1

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-2022177307-A1 INTERFERON GENE STIMULATOR COMPOSITION COMPRISING BENZIMIDAZOLE DERIVATIVE AS ACTIVE INGREDIENT 한국화학연구원 2022-08-25 — — WO disclosed
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