SCHEMBL22835874

SCHEMBL22835874

OCC[C@H]1CC[C@H](n2cc3ccc(Br)cc3n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B13 Q7Z5P4 5/20 0.39
IRAK4 Q9NWZ3 8/20 0.36
CRBN Q96SW2 1/20 0.36
ESR2 Q92731 2/20 0.33
TYK2 P29597 1/20 0.32
PNMT P11086 1/20 0.32
CCRL2 O00421 1/20 0.31
KDM2B Q8NHM5 1/20 0.30

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
SCHEMBL22835873 1.00 HSD17B13 (0.39) HSD17B13IRAK4CRBNESR2TYK2
SCHEMBL22836722 0.90 IRAK4 (0.41) HSD17B13IRAK4CRBNTYK2KDM2B
SCHEMBL22849080 0.90 IRAK4 (0.41) HSD17B13IRAK4CRBNTYK2KDM2B
SCHEMBL16595488 0.86 BACE1 (0.38) HSD17B13TYK2
SCHEMBL27213907 0.84 HSD17B13 (0.38) HSD17B13IRAK4CRBNTYK2
SCHEMBL27230890 0.84 HSD17B13 (0.38) HSD17B13IRAK4CRBNTYK2
Hydrochloric Acid SCHEMBL30849268 0.83 HSD17B13 (0.37) HSD17B13IRAK4CRBNTYK2
SCHEMBL22835612 0.82 HSD17B13 (0.41) HSD17B13IRAK4CRBNTYK2KDM2B
SCHEMBL22835613 0.82 HSD17B13 (0.41) HSD17B13IRAK4CRBNTYK2KDM2B
SCHEMBL26351602 0.81 HSD17B13 (0.41) HSD17B13IRAK4CRBNTYK2KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545659-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2026-02-10 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230069104-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-03-02 US disclosed
EP-3989966-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2022-05-04 EP disclosed
WO-2020264499-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-30 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 (3 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-12545659-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK4 HSD17B13 2379/4885IRAK4 3/4885CRBN 39/4885
US-20230069104-A1 IRAK DEGRADERS AND USES THEREOF IRAK4, IRAK2, IRAK3 HSD17B13 3799/4885IRAK4 1/4885CRBN 322/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HSD17B13 3277/4885IRAK4 4/4885CRBN 187/4885

“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.