SCHEMBL21753589

SCHEMBL21753589

CCn1nc(C)cc1C(=O)Nc1nc2cc(C#N)cc3c2n1[C@@H](CCOC(N)=O)CO3

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 19/20 0.46
ENPP1 P22413 1/20 0.43

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
SCHEMBL21766423 0.91 ENPP1 (0.46) STING1ENPP1
SCHEMBL21790360 0.90 STING1 (0.46) STING1ENPP1
SCHEMBL21766335 0.89 ENPP1 (0.48) STING1ENPP1
SCHEMBL21790027 0.89 STING1 (0.45) STING1ENPP1
SCHEMBL21753602 0.89 STING1 (0.55) STING1ENPP1
SCHEMBL23566944 0.88 ENPP1 (0.44) STING1ENPP1
SCHEMBL21753596 0.85 STING1 (0.54) STING1
SCHEMBL21753595 0.85 STING1 (0.54) STING1
SCHEMBL21766301 0.85 ENPP1 (0.48) STING1ENPP1
SCHEMBL21766491 0.85 STING1 (0.49) STING1ENPP1

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-2020038387-A1 HIGH ACTIVITY STING PROTEIN AGONIST 杭州阿诺生物医药科技有限公司 2020-02-27 WO disclosed