SCHEMBL22135104

SCHEMBL22135104

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C[C@H]1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 20/20 0.64
▸ TBK1 Q9UHD2 1/20 0.62

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
SCHEMBL22134990 0.96 STING1 (0.65) STING1TBK1
SCHEMBL22135094 0.93 STING1 (0.66) STING1TBK1
SCHEMBL22135322 0.91 STING1 (0.69) STING1TBK1
SCHEMBL22150054 0.88 STING1 (0.65) STING1TBK1
SCHEMBL22151352 0.86 STING1 (0.77) STING1TBK1
SCHEMBL22121262 0.84 STING1 (0.50) STING1TBK1
SCHEMBL22150053 0.83 STING1 (0.58) STING1TBK1
SCHEMBL22135087 0.82 STING1 (0.71) STING1TBK1
SCHEMBL22151323 0.81 STING1 (0.68) STING1TBK1
SCHEMBL22150552 0.81 STING1 (0.69) 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-2020132566-A1 STING PYRAZOLE 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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