SCHEMBL22136278

SCHEMBL22136278

CCCn1c(NC(=O)c2oc(C)nc2C)nc2cc(C(N)=O)cc(OCCCN3CCOCC3)c21

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 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
SCHEMBL22136286 0.88 STING1 (0.69) STING1
SCHEMBL22136242 0.87 STING1 (0.53) STING1
SCHEMBL22135916 0.85 STING1 (0.54) STING1
SCHEMBL22135955 0.85 STING1 (0.55) STING1
SCHEMBL21789961 0.84 STING1 (0.86) STING1
SCHEMBL22135930 0.84 STING1 (0.67) STING1
SCHEMBL22136238 0.84 STING1 (0.62) STING1
SCHEMBL22135960 0.83 STING1 (0.55) STING1
SCHEMBL22151657 0.83 STING1 (0.89) STING1
SCHEMBL31016355 0.83 STING1 (0.72) 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-2020132549-A1 STING HETEROCYCLE AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 WO disclosed