SCHEMBL21071014

SCHEMBL21071014

Cc1ccc(S(=O)(=O)O)c(CCOCCOCCOCCOCCOCCNC(=O)OC(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.43
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA9 Q16790 5/20 0.43
NQO2 P16083 1/20 0.41
BRD4 O60885 1/20 0.40
BCHE P06276 2/20 0.39
CNR2 P34972 2/20 0.39
FBP1 P09467 1/20 0.39
ADRB2 P07550 1/20 0.39
HTR1A P08908 1/20 0.39
IDO1 P14902 2/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL25294572 1.00 CA12 (0.43) CA12CA1CA2CA9NQO2
SCHEMBL18544355 0.99 CA12 (0.44) CA12CA1CA2CA9NQO2
SCHEMBL28989021 0.86 CA1 (0.47) CA12CA1CA2CA9NQO2
SCHEMBL597639 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL29040418 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL28468535 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL28899596 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL29040477 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL29040412 0.85 CA1 (0.48) CA12CA1CA2CA9NQO2
SCHEMBL21070849 0.83 CA1 (0.49) CA12CA1CA2CA9NQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-20230106066-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-20230398223-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CA12 4583/4885CA1 4622/4885CA2 4617/4885
US-20190192668-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.