SCHEMBL22136247

SCHEMBL22136247

CCc1nn(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc(OC)c2n1CCCNC(=O)OCc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.73
IRF3 Q14653 1/20 0.63

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
SCHEMBL22135946 0.89 STING1 (0.72) STING1IRF3
SCHEMBL22136254 0.88 STING1 (0.67) STING1IRF3
SCHEMBL22136126 0.88 STING1 (0.68) STING1IRF3
SCHEMBL22136275 0.87 STING1 (0.81) STING1IRF3
SCHEMBL22136273 0.85 STING1 (0.77) STING1IRF3
SCHEMBL22136141 0.85 STING1 (0.74) STING1IRF3
SCHEMBL22135931 0.85 STING1 (0.74) STING1IRF3
SCHEMBL22136261 0.85 STING1 (0.77) STING1IRF3
SCHEMBL22136128 0.84 STING1 (0.61) STING1
SCHEMBL22136135 0.84 STING1 (0.82) STING1IRF3

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-2020132549-A1 STING HETEROCYCLE AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 WO disclosed