SCHEMBL23326714

SCHEMBL23326714

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(N)nc43)C(=O)[C@@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 11/20 0.41
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39

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
SCHEMBL20774144 0.87 TAAR1 (0.40) STING1PDE3BPDE3ATAAR1ADORA3
SCHEMBL20774145 0.87 TAAR1 (0.40) STING1PDE3BPDE3ATAAR1ADORA3
SCHEMBL19949242 0.84 ADORA3 (0.41) PDE3AADORA3
SCHEMBL19953772 0.84 ADORA3 (0.41) PDE3AADORA3
SCHEMBL12729604 0.84 STING1 (0.46) STING1PDE3BPDE3A
SCHEMBL8620596 0.84 STING1 (0.46) STING1PDE3BPDE3A
SCHEMBL29603744 0.83 HINT1 (0.40) STING1PDE3BPDE3ATAAR1
SCHEMBL10239049 0.83 ADORA2A (0.39) STING1ADORA3
SCHEMBL22983981 0.81 STING1 (0.60) STING1PDE3BPDE3A
SCHEMBL14946363 0.81 STING1 (0.60) STING1PDE3BPDE3A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11267844-B2 Spirothietane nucleosides JANSSEN PHARMACEUTICA NV (BE) 2022-03-08 — — US disclosed
EP-3676276-B1 SPIROTHIETANE NUCLEOSIDES JANSSEN PHARMACEUTICA NV (BE) 2021-12-08 — — EP disclosed
US-20210139524-A1 SPIROTHIETANE NUCLEOSIDES JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 — — US 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-11267844-B2 Spirothietane nucleosides SAMHD1, SLC28A1, SLC28A2 STING1 2029/4885PDE3B 482/4885PDE3A 347/4885
US-20210139524-A1 SPIROTHIETANE NUCLEOSIDES SAMHD1, SLC28A1, SLC28A2 STING1 2029/4885PDE3B 482/4885PDE3A 347/4885

“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.

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