SCHEMBL22856437

SCHEMBL22856437

CC(C)(C)OC(=O)N1CCO[C@H](COCCBr)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ PDK1 Q15118 7/20 0.43
▸ EPHA2 P29317 4/20 0.43
▸ RECQL P46063 1/20 0.40
▸ ERBB2 P04626 1/20 0.39
▸ EPHB4 P54760 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ NR1H2 P55055 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ P2RX3 P56373 2/20 0.36
▸ P2RX2 Q9UBL9 2/20 0.36

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
SCHEMBL22856094 1.00 USP2 (0.44) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL22856599 0.89 PDK1 (0.50) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL22856574 0.89 PDK1 (0.50) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL31493955 0.89 PDK1 (0.50) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL8140489 0.86 PDK1 (0.54) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL17897027 0.86 PDK1 (0.54) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL30962180 0.86 PDK1 (0.59) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL23807943 0.85 USP2 (0.43) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL22856401 0.85 USP2 (0.43) USP2SMN1; SMN2PDK1EPHA2RECQL
SCHEMBL23807942 0.84 MEN1 (0.45) USP2SMN1; SMN2PDK1EPHA2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230089916-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-03-23 — — US disclosed
WO-2020264490-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 (1 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-20230089916-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK1, IRAK3 USP2 398/4885SMN1; SMN2 3491/4885PDK1 380/4885

“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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