SCHEMBL21105776

SCHEMBL21105776

CC(=O)N1CCN([C@H]2CC[C@H](Nc3ncnc4[nH]cc(C5CCOCC5)c34)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 18/20 1.00
▸ IRAK1 P51617 3/20 0.78
▸ IRAK3 Q9Y616 2/20 0.78
▸ CLK1 P49759 2/20 0.78
▸ CLK2 P49760 2/20 0.78
▸ CLK4 Q9HAZ1 2/20 0.78
▸ IRAK2 O43187 1/20 0.78
▸ HASPIN Q8TF76 1/20 0.78
▸ CCNT1 O60563 1/20 0.65
▸ CCNC P24863 1/20 0.65
▸ CDK8 P49336 1/20 0.65
▸ CDK7 P50613 1/20 0.65
▸ CDK9 P50750 1/20 0.65
▸ CCNH P51946 1/20 0.65
▸ MNAT1 P51948 1/20 0.65
▸ BTK Q06187 1/20 0.52
▸ JAK3 P52333 1/20 0.52

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
SCHEMBL21106080 0.91 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL21105773 0.90 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL23945382 0.88 IRAK4 (0.84) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL23945438 0.88 IRAK4 (0.84) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL22906395 0.88 IRAK4 (0.84) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL23860570 0.88 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL23763239 0.88 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL21105720 0.88 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL21106082 0.88 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2
SCHEMBL30264224 0.88 IRAK4 (1.00) IRAK4IRAK1IRAK3CLK1CLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024092011-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-05-02 — — WO disclosed
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-12-14 — — US disclosed
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-12-14 — — US disclosed
WO-2023192586-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-10-05 — — WO disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 — — US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 — — US disclosed
US-20230132715-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 — — US disclosed
US-20230132715-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 — — US disclosed
WO-2022125790-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 — — WO disclosed
US-11318205-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-05-03 — — US disclosed
WO-2022087216-A1 DOUBLE DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-04-28 — — WO disclosed
WO-2021011868-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-01-21 — — WO disclosed
US-10874743-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2020-12-29 — — US disclosed
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2019-06-27 — — 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 (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-10874743-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885
US-20230132715-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885
US-11723980-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885
US-11318205-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 IRAK4 4/4885IRAK1 3/4885IRAK3 2/4885

“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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