SCHEMBL23813582

SCHEMBL23813582

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C(S)[C@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.46
▸ ERBB2 P04626 1/20 0.46
▸ STING1 Q86WV6 8/20 0.45
▸ LMNA P02545 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ RAPGEF3 O95398 2/20 0.45
▸ GMNN O75496 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ RAPGEF4 Q8WZA2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ RXFP1 Q9HBX9 2/20 0.44
▸ AHCY P23526 2/20 0.43

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
SCHEMBL14946326 0.90 STING1 (0.46) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL14946345 0.89 STING1 (0.45) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL9964279 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL16271105 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL22983991 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL14946346 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL6895355 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL23813544 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL14946351 0.89 STING1 (0.45) STING1LMNAKMT2ARAPGEF3GMNN
SCHEMBL29674371 0.89 STING1 (0.56) STING1LMNAKMT2ARAPGEF3GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11597745-B2 β-modified phosphoric acid compound precursor, β-modified phosphoric acid compound, reaction inhibitor and medicine containing the same, and method for inhibiting reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-03-07 — — US disclosed
US-20210284679-A1 ß-Modified Phosphoric Acid Compound Precursor, ß-Modified Phosphoric Acid Compound, Reaction Inhibitor and Medicine Containing the Same, and Method for Inhibiting Reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2021-09-16 — — 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-11597745-B2 β-modified phosphoric acid compound precursor, β-modified phosphoric acid compound, reaction inhibitor and medicine containing the same, and method for inhibiting reaction PPM1A, PPM1G, PPM1F EGFR 1445/4885ERBB2 1148/4885STING1 742/4885
US-20210284679-A1 ß-Modified Phosphoric Acid Compound Precursor, ß-Modified Phosphoric Acid Compound, Reaction Inhibitor and Medicine Containing the Same, and Method for Inhibiting Reaction IRS1, PPM1A, PPM1G EGFR 959/4885ERBB2 762/4885STING1 827/4885

“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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