SCHEMBL22715071

SCHEMBL22715071

CC(C)(C)OC(=O)n1nc(N)c2cc(-c3cccc(I)c3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.48
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
NR1H2 P55055 1/20 0.36
MAP4K4 O95819 2/20 0.35
KDR P35968 3/20 0.35
PIK3CD O00329 2/20 0.35
ABL1 P00519 2/20 0.35
EGFR P00533 2/20 0.35
HCK P08631 2/20 0.35
SRC P12931 2/20 0.35
PIK3CA P42336 2/20 0.35
PIK3CB P42338 2/20 0.35
MTOR P42345 2/20 0.35
PIK3CG P48736 2/20 0.35
EPHB4 P54760 2/20 0.35
PRKDC P78527 2/20 0.35
PI4KB Q9UBF8 2/20 0.35
F12 P00748 1/20 0.35

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
SCHEMBL29439673 1.00 MAP2K4 (0.48) MAP2K4GABRG2GABRB3GABRA5NR1H2
SCHEMBL28710646 0.86 MAP2K4 (0.47) MAP2K4GABRG2GABRB3GABRA5NR1H2
SCHEMBL29439666 0.86 MAP2K4 (0.47) MAP2K4GABRG2GABRB3GABRA5NR1H2
SCHEMBL22716110 0.82 GSK3B (0.37) MAP4K4DYRK3ROCK2MAPK1CLK2
SCHEMBL660243 0.80 MAP2K4 (0.45) MAP2K4GABRG2GABRB3GABRA5NR1H2
SCHEMBL13748554 0.78 MAP2K4 (0.44) MAP2K4GABRG2GABRB3GABRA5NR1H2
SCHEMBL16800567 0.77 MAP2K4 (0.46) MAP2K4GABRG2GABRB3GABRA5KDR
SCHEMBL29439761 0.77 PDGFRA (0.52) MAP2K4GABRG2GABRB3GABRA5KDR
SCHEMBL1943689 0.77 PDGFRA (0.52) MAP2K4GABRG2GABRB3GABRA5KDR
SCHEMBL4285222 0.77 CDC7 (0.53) MAP2K4MAP4K4KDRDYRK3ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2026-05-05 US disclosed
EP-4467199-A2 SMALL MOLECULE INHIBITORS OF NF-KB INDUCING KINASE JANSSEN Pharmaceutica NV (BE) 2024-11-27 EP disclosed
EP-3976597-B1 SMALL MOLECULE INHIBITORS OF NF-KB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2024-08-28 EP disclosed
US-20240199605-A1 SMALL MOLECULAR INHIBITORS OF NF-kB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2024-06-20 US disclosed
US-11827634-B2 Small molecule inhibitors of NF-kB inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2023-11-28 US disclosed
US-20230080834-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2023-03-16 US disclosed
CN-114222737-A Small molecule inhibitor of NF-kB induced kinase 詹森药业有限公司 2022-03-22 CN disclosed
US-11254673-B2 Small molecule inhibitors of NF-κB inducing kinase JANSSEN PHARMACEUTICA NV (BE) 2022-02-22 US disclosed
US-20210300918-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 US disclosed
WO-2020239999-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2020-12-03 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 (6 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-20210300918-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE NFKBIA, IKBKB, NFRKB MAP2K4 133/4885GABRG2 4178/4885GABRB3 4040/4885
US-20230080834-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE NFKBIA, IKBKB, NFRKB MAP2K4 133/4885GABRG2 4178/4885GABRB3 4040/4885
US-11827634-B2 Small molecule inhibitors of NF-kB inducing kinase NFKBIA, IKBKB, NFRKB MAP2K4 133/4885GABRG2 4178/4885GABRB3 4040/4885
US-11254673-B2 Small molecule inhibitors of NF-κB inducing kinase NFKBIA, IKBKB, CHUK MAP2K4 168/4885GABRG2 4196/4885GABRB3 4397/4885
US-12617789-B2 Small molecular inhibitors of NF-κb inducing kinase IRAK3, IKBKB, IKBKG MAP2K4 181/4885GABRG2 4239/4885GABRB3 3428/4885
US-20240199605-A1 SMALL MOLECULAR INHIBITORS OF NF-kB INDUCING KINASE NFKBIA, IKBKB, IKBKE MAP2K4 126/4885GABRG2 3924/4885GABRB3 3827/4885

“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.