SCHEMBL22135286

SCHEMBL22135286

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc(OC)c2n1CCCNC(=O)OCc1ccc(C(=O)OC)cn1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.81
IRF3 Q14653 1/20 0.74

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
SCHEMBL22135225 0.95 STING1 (0.81) STING1
SCHEMBL22135227 0.92 STING1 (0.75) STING1
SCHEMBL22135075 0.90 STING1 (0.84) STING1
SCHEMBL22135211 0.89 STING1 (1.00) STING1
SCHEMBL22135223 0.89 STING1 (0.77) STING1
SCHEMBL19449091 0.87 STING1 (1.00) STING1IRF3
SCHEMBL22135076 0.87 STING1 (1.00) STING1
SCHEMBL22135025 0.87 STING1 (0.82) STING1
SCHEMBL22135324 0.86 STING1 (0.82) STING1
SCHEMBL22135216 0.86 STING1 (0.91) 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
WO-2020132566-A1 STING PYRAZOLE AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 WO disclosed