SCHEMBL21998197

SCHEMBL21998197

CC(OCCOCCOC12CC3CC(CC(C3)C1)C2)OS(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.36
TSHR P16473 1/20 0.36
EPHX2 P34913 4/20 0.34
ALDH1A1 P00352 4/20 0.33
LMNA P02545 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL21996771 0.79 SMN1; SMN2 (0.40) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL15532287 0.79 SMN1; SMN2 (0.40) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL15532690 0.79 SMN1; SMN2 (0.40) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL15532609 0.79 SMN1; SMN2 (0.40) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL1174646 0.75 ALDH1A1 (0.35) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL23780307 0.74 ALDH1A1 (0.38) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL1174643 0.74 NPSR1 (0.35) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL16682526 0.70 EPHX2 (0.44) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL25753188 0.70 EPHX2 (0.45) SMN1; SMN2TSHREPHX2ALDH1A1LMNA
SCHEMBL15533591 0.70 EPHX2 (0.45) SMN1; SMN2TSHREPHX2ALDH1A1LMNA

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-20240239777-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-07-18 US disclosed
US-11807636-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-11-07 US disclosed
US-11352350-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-06-07 US disclosed
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-10-21 US disclosed
EP-3886904-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2021-10-06 EP disclosed
US-11117889-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2021-09-14 US disclosed
WO-2020113233-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-06-04 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 (5 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-11117889-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 SMN1; SMN2 2647/4885TSHR 3319/4885EPHX2 1890/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 SMN1; SMN2 2647/4885TSHR 3319/4885EPHX2 1890/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 SMN1; SMN2 2647/4885TSHR 3319/4885EPHX2 1890/4885
US-20240239777-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 SMN1; SMN2 2647/4885TSHR 3319/4885EPHX2 1890/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 SMN1; SMN2 2647/4885TSHR 3319/4885EPHX2 1890/4885

“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.