SCHEMBL29212439

SCHEMBL29212439

C#CCNc1ccc(S(C)(=O)=O)c2cc[nH]c12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ BRD4 O60885 10/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ NR3C2 P08235 1/20 0.35
▸ AR P10275 1/20 0.35
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ ADRA1A P35348 5/20 0.32
▸ ADRA2C P18825 3/20 0.31
▸ ADRA1D P25100 3/20 0.31
▸ ADRA1B P35368 3/20 0.31
▸ ADRA2A P08913 2/20 0.31

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
SCHEMBL25032367 0.78 CA12 (0.32) CA12CA1CA2CA9
SCHEMBL838565 0.69 CCR2 (0.37) BRD4NR3C1PGRNR3C2AR
SCHEMBL30832725 0.69 L3MBTL1 (0.38) BRD4NR3C1PGRNR3C2AR
SCHEMBL29212355 0.67 NR3C1 (0.51) BRD4NR3C1PGRNR3C2AR
SCHEMBL30184459 0.67 NR3C1 (0.51) BRD4NR3C1PGRNR3C2AR
SCHEMBL29212344 0.66 HTR6 (0.40) —
SCHEMBL29212291 0.66 CA12 (0.36) CA12CA1CA2CA9MAOA
SCHEMBL31363366 0.65 LRRK2 (0.34) CA12CA1CA2CA9MAOA
SCHEMBL30184522 0.65 CA12 (0.35) CA12CA1CA2CA9MAOA
SCHEMBL25033661 0.65 CA12 (0.35) CA12CA1CA2CA9MAOA

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
CN-119968361-A Compounds targeting p 53Y 220 mutants 北京加科思新药研发有限公司 2025-05-09 — — CN disclosed
US-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-12-05 — — US disclosed
EP-4384510-A1 COMPOUNDS TARGETING MUTANT OF P53 Jacobio Pharmaceuticals Co., Ltd. (CN) 2024-06-19 — — EP disclosed
CN-117813295-A Compounds targeting p53 mutants 北京加科思新药研发有限公司 2024-04-02 — — CN disclosed
WO-2024041503-A1 COMPOUNDS TARGETING Y220C MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-02-29 — — WO disclosed
WO-2023016434-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-16 — — 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-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 TP53, TP53BP1, MDM2 CA12 3295/4885CA1 2782/4885CA2 3601/4885

“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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