SCHEMBL23326499

SCHEMBL23326499

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(N)nc43)[C@@]3(CCS3)[C@@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 8/20 0.39
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL23326498 1.00 STING1 (0.39) STING1PDE3BPDE3AADORA3POLB
SCHEMBL23351465 0.86 KDM4E (0.45) STING1
SCHEMBL20154884 0.82 STING1 (0.41) STING1PDE3BPDE3AADORA3
SCHEMBL8620596 0.81 STING1 (0.46) STING1PDE3BPDE3APOLB
SCHEMBL12729604 0.81 STING1 (0.46) STING1PDE3BPDE3APOLB
SCHEMBL23326714 0.78 STING1 (0.41) STING1PDE3BPDE3AADORA3TAAR1
SCHEMBL9964274 0.77 STING1 (0.60) STING1PDE3BPDE3A
SCHEMBL22983981 0.77 STING1 (0.60) STING1PDE3BPDE3A
SCHEMBL20149810 0.77 STING1 (0.60) STING1PDE3BPDE3A
SCHEMBL14946328 0.77 STING1 (0.51) 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.

Send feedback