SCHEMBL23015355

SCHEMBL23015355

COC(=O)c1ccc(C#C[Si](C)(C)C)nn1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ NNMT P40261 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NOTUM Q6P988 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAOA P21397 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL1456298 0.78 MAPK1 (0.57) MAPK1L3MBTL1KDM4ENNMTTP53
SCHEMBL29442775 0.78 MAPK1 (0.57) MAPK1L3MBTL1KDM4ENNMTTP53
SCHEMBL20912018 0.78 MAPK1 (0.47) MAPK1L3MBTL1KDM4ENNMTTP53
SCHEMBL8175471 0.77 MAPT (0.46) L3MBTL1KDM4ETP53MAPTCYP1A2
SCHEMBL31044569 0.73 MAPK1 (0.54) MAPK1L3MBTL1KDM4ECYP1A2
SCHEMBL2721535 0.73 MAPK1 (0.54) MAPK1L3MBTL1KDM4EMAPTKMT2A
SCHEMBL155925 0.73 MAPK1 (0.54) MAPK1L3MBTL1KDM4ECYP1A2
SCHEMBL3752771 0.72 MAPK1 (0.35) MAPK1KDM4ETP53MAPTHSD17B10
SCHEMBL24078823 0.72 NNMT (0.36) KDM4ENNMT
SCHEMBL29598289 0.72 NNMT (0.36) KDM4ENNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023103850-A1 SMALL MOLECULE STING AGONIST, PREPARATION METHOD THEREFOR, AND APPLICATION 中国科学院上海药物研究所 2023-06-15 — — WO disclosed
US-20220288065-A1 MONOCYCLIC AGONISTS OF STIMULATOR OF INTERFERON GENES STING THE SCRIPPS RESEARCH INSTITUTE 2022-09-15 — — US disclosed
CN-114981256-A Single-ring agonists of the interferon gene stimulator STING 斯克里普斯研究学院 2022-08-30 — — CN disclosed
EP-4017592-A1 MONOCYCLIC AGONISTS OF STIMULATOR OF INTERFERON GENES STING The Scripps Research Institute (US) 2022-06-29 — — EP disclosed
WO-2021035257-A1 MONOCYCLIC AGONISTS OF STIMULATOR OF INTERFERON GENES STING THE SCRIPPS RESEARCH INSTITUTE (US) 2021-02-25 — — WO disclosed
WO-2021035257-A1 MONOCYCLIC AGONISTS OF STIMULATOR OF INTERFERON GENES STING THE SCRIPPS RESEARCH INSTITUTE (US) 2021-02-25 — — 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 (1 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-20220288065-A1 MONOCYCLIC AGONISTS OF STIMULATOR OF INTERFERON GENES STING STING1, IRF3, CGAS MAPK1 3141/4885L3MBTL1 4203/4885KDM4E 2705/4885

“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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