SCHEMBL22121341

SCHEMBL22121341

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(=O)O)ccc2n1C/C=C/Cn1c(N)nc2cc(C(N)=O)ccc21

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 20/20 0.70
▸ TBK1 Q9UHD2 1/20 0.70

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
SCHEMBL22121345 1.00 STING1 (0.70) STING1TBK1
SCHEMBL22150350 0.97 STING1 (0.75) STING1TBK1
SCHEMBL23227750 0.96 STING1 (0.76) STING1TBK1
SCHEMBL19451598 0.96 STING1 (0.76) STING1TBK1
SCHEMBL19451602 0.93 STING1 (0.74) STING1TBK1
SCHEMBL19451632 0.93 STING1 (0.81) STING1TBK1
SCHEMBL29702138 0.93 STING1 (0.81) STING1TBK1
SCHEMBL22149041 0.92 STING1 (0.68) STING1TBK1
SCHEMBL22151467 0.91 STING1 (0.67) STING1TBK1
SCHEMBL22149039 0.91 STING1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020132582-A1 STING AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 — — WO disclosed
WO-2020132582-A1 STING AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 — — WO disclosed
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