SCHEMBL26979848

SCHEMBL26979848

COC(=O)c1n[nH]c2cc(C3=CCOCC3)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.48
▸ STAT3 P40763 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ GSK3B P49841 1/20 0.47
▸ MAP2K4 P45985 2/20 0.41
▸ IDH1 O75874 2/20 0.39
▸ PAK1 Q13153 2/20 0.39
▸ LRRK2 Q5S007 1/20 0.39
▸ PIK3CD O00329 2/20 0.38
▸ PIK3R1 P27986 2/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ PIK3CB P42338 2/20 0.38
▸ PIK3CG P48736 2/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ CDC7 O00311 1/20 0.37
▸ IKBKE Q14164 1/20 0.37
▸ TBK1 Q9UHD2 1/20 0.37
▸ JAK2 O60674 2/20 0.37
▸ JAK1 P23458 2/20 0.37
▸ TYK2 P29597 2/20 0.37

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
SCHEMBL29644269 1.00 KDM4E (0.48) KDM4ESTAT3HIF1AGSK3BMAP2K4
SCHEMBL492421 0.86 GSK3B (0.50) GSK3BIKBKETBK1
SCHEMBL2856720 0.79 GSK3B (0.46) KDM4EGSK3BIDH1PAK1
SCHEMBL13528913 0.79 GSK3B (0.46) KDM4EGSK3BIDH1PAK1
SCHEMBL2088884 0.78 DYRK1A (0.56) GSK3BPAK1
SCHEMBL1572799 0.77 GSK3B (0.59) GSK3BIKBKETBK1JAK2
SCHEMBL1176284 0.76 GSK3B (0.45) GSK3BIDH1PAK1SCN9AIKBKE
SCHEMBL5043690 0.76 GSK3B (0.45) GSK3BIDH1PAK1SCN9AIKBKE
Formic Acid SCHEMBL2854182 0.76 GSK3B (0.43) KDM4EGSK3BIDH1PAK1
SCHEMBL2088724 0.76 GSK3B (0.49) GSK3BPAK1JAK2JAK1TYK2

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
EP-4247790-B1 STING ANTAGONISTS AND USES THEREOF REGOR PHARMACEUTICALS INC (US) 2024-10-09 — — EP disclosed
US-20240002368-A1 STING ANTAGONISTS AND USES THEREOF REGOR PHARMACEUTICALS, INC. 2024-01-04 — — US disclosed
CN-116867768-A STING antagonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-10-10 — — CN 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-20240002368-A1 STING ANTAGONISTS AND USES THEREOF STING1, TBK1, CGAS KDM4E 3751/4885STAT3 81/4885HIF1A 2827/4885

“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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