SCHEMBL484122

SCHEMBL484122

CN(C(=O)OC(C)(C)C)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.45
BACE1 P56817 1/20 0.44
BACE2 Q9Y5Z0 1/20 0.44
USP30 Q70CQ3 2/20 0.43
PAX8 Q06710 1/20 0.42
F11 P03951 3/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
F2 P00734 2/20 0.40
PRSS1 P07477 2/20 0.40
PRSS2 P07478 2/20 0.40
PRSS3 P35030 2/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
LPL P06858 3/20 0.40
LIPG Q9Y5X9 3/20 0.40
DGAT1 O75907 1/20 0.39
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39

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
SCHEMBL23753406 0.96 LIPG (0.47) AAK1BACE1BACE2USP30PAX8
SCHEMBL12185974 0.87 BACE1 (0.49) AAK1BACE1BACE2USP30F11
SCHEMBL18204544 0.85 BACE1 (0.45) AAK1BACE1BACE2USP30F11
SCHEMBL1750582 0.84 BRD4 (0.44) AAK1BACE1BACE2USP30PAX8
SCHEMBL17419130 0.84 CA1 (0.43) AAK1F11CA1CA2CA9
SCHEMBL1019640 0.84 BACE1 (0.45) AAK1BACE1BACE2USP30F11
SCHEMBL2592445 0.83 USP30 (0.57) AAK1BACE1BACE2USP30F11
SCHEMBL30175895 0.83 BACE1 (0.46) AAK1BACE1BACE2USP30F11
SCHEMBL2595119 0.83 AAK1 (0.45) AAK1BACE1BACE2USP30F11
SCHEMBL13394297 0.82 BRD4 (0.39) AAK1BACE1BACE2USP30PAX8

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 177 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2025-12-25 US disclosed
US-12172991-B2 Bicycle topoisomerase i inhibiting compounds, process for preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2024-12-24 US disclosed
US-11884721-B2 Erythrocyte-binding therapeutics ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2024-01-30 US disclosed
US-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2022-11-03 US disclosed
US-20220125945-A1 COMPOSITIONS AND METHODS FOR INDUCING ANTIGEN-SPECIFIC TOLERANCE ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2022-04-28 US disclosed
US-11246943-B2 Antigen-specific tolerance and compositions for induction of same ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2022-02-15 US disclosed
EP-3426653-B1 BICYCLIC COMPOUNDS FOR DIAGNOSIS AND THERAPY AC IMMUNE SA (CH) 2021-12-15 EP disclosed
US-20210246128-A1 BICYCLE TOPOISOMERASE I INHIBITING COMPOUNDS, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-08-12 US disclosed
US-20210238277-A1 ERYTHROCYTE-BINDING THERAPEUTICS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-08-05 US disclosed
US-20210079077-A1 ERYTHROCYTE-BINDING THERAPEUTICS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-03-18 US disclosed
US-20080220003-A1 C5a Receptor Antagonists JERINI AG (DE) 2008-09-11 US disclosed
US-20080220003-A1 C5a Receptor Antagonists JERINI AG (DE) 2008-09-11 US disclosed
US-20080176891-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-07-24 US disclosed
US-20080146606-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-06-19 US disclosed
WO-2008034860-A1 PYRROLO[2, 3-B]PYRIDIN-4-YL-BENZENESULFONAMIDE COMPOUNDS AS IKK2 INHIBITORS GLAXO GROUP LIMITED (GB) 2008-03-27 WO disclosed
EP-1902028-A2 HISTAMINE H3 RECEPTOR ANTAGONISTS Novo Nordisk A/S (DK) 2008-03-26 EP disclosed
EP-1844056-A2 SULFONAMIDO-MACROCYCLES AS TIE2 INHIBITORS Bayer Schering Pharma Aktiengesellschaft (DE) 2007-10-17 EP disclosed
WO-2007003604-A2 HISTS1MINE H3 RECEPTOR ANTAGONISTS NOVO NORDISK A/S (DK) 2007-01-11 WO disclosed
US-20060167030-A1 Sulfonamido-macrocycles and the salts thereof, a pharmaceutical composition comprising these compounds, the method of preparing and the use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-07-27 US disclosed
WO-2006066957-A2 SULFONAMIDO-MACROCYCLES AS TIE2 INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-06-29 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 (8 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-20060167030-A1 Sulfonamido-macrocycles and the salts thereof, a pharmaceutical composition comprising these compounds, the method of preparing and the use thereof TEK, KDR, FLT1 AAK1 1264/4885BACE1 1952/4885BACE2 997/4885
US-20080176891-A1 NOVEL COMPOUNDS NFKBIA, IKBKG, IKBKE AAK1 651/4885BACE1 1797/4885BACE2 628/4885
US-20080146606-A1 NOVEL COMPOUNDS NFKBIA, IKBKG, IKBKE AAK1 651/4885BACE1 1797/4885BACE2 628/4885
US-12172991-B2 Bicycle topoisomerase i inhibiting compounds, process for preparation and use thereof TOP1, TOP2A, TOP2B AAK1 2502/4885BACE1 1714/4885BACE2 2365/4885
US-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, MTOR AAK1 1134/4885BACE1 1819/4885BACE2 2627/4885
US-20080220003-A1 C5a Receptor Antagonists C3AR1, C5AR2, C5AR1 AAK1 3853/4885BACE1 4226/4885BACE2 4131/4885
US-20210246128-A1 BICYCLE TOPOISOMERASE I INHIBITING COMPOUNDS, PROCESS FOR PREPARATION AND USE THEREOF TOP1, TOP2A, TOP2B AAK1 2502/4885BACE1 1714/4885BACE2 2365/4885
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3C2B, PIK3C2A, PIK3R1 AAK1 1674/4885BACE1 2173/4885BACE2 2619/4885

“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.