SCHEMBL21789638

SCHEMBL21789638

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc3c2n1[C@@H](CCCNc1c(N)cc(C(N)=O)cc1OC)CO3

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.55

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
SCHEMBL21790356 1.00 STING1 (0.55) STING1
SCHEMBL21790018 0.94 STING1 (0.53) STING1
SCHEMBL21789949 0.94 STING1 (0.53) STING1
SCHEMBL21790398 0.93 STING1 (0.57) STING1
SCHEMBL21789704 0.91 STING1 (0.51) STING1
SCHEMBL23855742 0.91 STING1 (0.52) STING1
SCHEMBL21789940 0.91 STING1 (0.53) STING1
SCHEMBL21789653 0.89 STING1 (0.59) STING1
SCHEMBL21789622 0.88 STING1 (0.49) STING1
SCHEMBL22109889 0.87 STING1 (0.56) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11535633-B2 Fused tricyclic heterocycle compounds and therapeutic uses thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2022-12-27 US disclosed
US-11535633-B2 Fused tricyclic heterocycle compounds and therapeutic uses thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2022-12-27 US disclosed
US-20210300944-A1 FUSED TRICYCLIC HETEROCYCLE COMPOUNDS AND THERAPEUTIC USES THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2021-09-30 US disclosed
US-20210300944-A1 FUSED TRICYCLIC HETEROCYCLE COMPOUNDS AND THERAPEUTIC USES THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2021-09-30 US disclosed
WO-2020042995-A1 HIGHLY ACTIVE STING PROTEIN AGONIST COMPOUND 杭州阿诺生物医药科技有限公司 2020-03-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11535633-B2 Fused tricyclic heterocycle compounds and therapeutic uses thereof STING1, CGAS, MAVS STING1 1/4885
US-20210300944-A1 FUSED TRICYCLIC HETEROCYCLE COMPOUNDS AND THERAPEUTIC USES THEREOF STING1, CGAS, MAVS STING1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.