SCHEMBL30540453

SCHEMBL30540453

Cc1cn(COCC[Si](C)(C)C)c2c(CN3CCC[C@H](C)C3)cc(C(=O)O)nc12

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.39
▸ KDM4E B2RXH2 8/20 0.36
▸ LMNA P02545 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RECQL P46063 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ GAA P10253 2/20 0.34
▸ HRH3 Q9Y5N1 3/20 0.33
▸ TP53 P04637 2/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL30540610 0.93 KDM4E (0.36) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL31115338 0.93 KDM4E (0.36) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30540580 0.91 KLKB1 (0.37) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30577653 0.90 KLKB1 (0.36) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30577632 0.90 KLKB1 (0.42) KLKB1ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL31115342 0.85 GRM2 (0.35) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL31115364 0.85 KLKB1 (0.33) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30540464 0.85 KLKB1 (0.33) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30540583 0.85 GRM2 (0.35) KLKB1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL30577554 0.84 GRM2 (0.33) KLKB1KDM4ELMNAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250163047-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE, LTD. (KY) 2025-05-22 — — US disclosed
EP-4476219-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BeiGene, Ltd. (KY) 2024-12-18 — — EP disclosed
CN-118696043-A Heterocyclic compounds, compositions thereof and methods of treatment therewith 百济神州有限公司 2024-09-24 — — CN disclosed
WO-2023151636-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-08-17 — — WO disclosed
WO-2023151641-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-08-17 — — 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-20250163047-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH NFATC1, GZMB, IFNG KLKB1 3730/4885KDM4E 996/4885LMNA 2546/4885

“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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