SCHEMBL25729664

SCHEMBL25729664

CC(I)NCCCn1cc(CNC(=O)C(C)(C)C)nn1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GLS O94925 4/20 0.38
GBA1 P04062 11/20 0.37
GSK3B P49841 1/20 0.36
MAPT P10636 1/20 0.36
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35

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
SCHEMBL23696408 0.91 ADRB2 (0.40) GLSGBA1MAPTADRB2ADRB1
SCHEMBL25477544 0.86 GLS (0.39) GLSGBA1ADRB2ADRB1
SCHEMBL21992355 0.81 MAPT (0.39) GLSGBA1MAPT
SCHEMBL23945848 0.80 GBA1 (0.44) GLSGBA1MAPT
SCHEMBL26401475 0.77 ADRB2 (0.42) GLSGBA1ADRB2ADRB1
SCHEMBL22861721 0.76 GLS (0.46) GLSGBA1ADRB2ADRB1
SCHEMBL21106552 0.76 ADRB2 (0.44) GLSGBA1ADRB2ADRB1
SCHEMBL16576128 0.74 FNTA (0.36) MAPT
SCHEMBL25446872 0.73 GLS (0.37) GLSGBA1
SCHEMBL23568346 0.72 GLS (0.41) GLSGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144292-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-11 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 (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-20230144292-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 GLS 4492/4885GBA1 3212/4885GSK3B 663/4885

“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.