SCHEMBL29612684

SCHEMBL29612684

CC(C)(C)OC(=O)NCCOCc1ccc(COCCN=[N+]=[N-])nc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.38
CA1 P00915 5/20 0.38
CA2 P00918 5/20 0.38
CA9 Q16790 5/20 0.38
IDO1 P14902 1/20 0.37
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
IL6 P05231 2/20 0.35
TLR7 Q9NYK1 2/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SUCNR1 Q9BXA5 1/20 0.35
SCN9A Q15858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL21107304 1.00 CA12 (0.38) CA12CA1CA2CA9IDO1
SCHEMBL21069517 0.85 CRBN (0.36) CA2CA9OPRM1OPRD1OPRK1
SCHEMBL21107305 0.84 CA1 (0.43) CA12CA1CA2CA9IDO1
SCHEMBL29612726 0.84 CA1 (0.43) CA12CA1CA2CA9IDO1
SCHEMBL21107306 0.83 CA12 (0.43) CA12CA1CA2CA9IDO1
SCHEMBL29612932 0.83 CA12 (0.43) CA12CA1CA2CA9IDO1
SCHEMBL28506992 0.81 OPRM1 (0.34) OPRM1OPRD1OPRK1
SCHEMBL13612357 0.79 TDP1 (0.44) CA12CA1CA2CA9IDO1
SCHEMBL13759224 0.78 TDP1 (0.43) CA12CA1CA2CA9IDO1
SCHEMBL17739953 0.78 TDP1 (0.43) CA12CA1CA2CA9IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250325673-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS INC (US) 2025-10-23 US disclosed
EP-4613773-A2 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2025-09-10 EP disclosed
EP-3731869-B1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS INC (US) 2025-07-23 EP disclosed
US-20250000985-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-01-02 US disclosed
US-12168057-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2024-12-17 US disclosed
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-12-14 US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 US disclosed
US-20230106066-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-06 US disclosed
US-11318205-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-05-03 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 (7 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-20230106066-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-20250325673-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-20250000985-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-11723980-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-12168057-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-11318205-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885

“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.