SCHEMBL26401475

SCHEMBL26401475

CC(=O)NCc1cn(CCCNC(C)C)nn1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.42
ADRB1 P08588 2/20 0.42
NOTUM Q6P988 1/20 0.42
GLS O94925 3/20 0.41
GBA1 P04062 9/20 0.40

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
SCHEMBL23602185 0.90 ADRB2 (0.42) ADRB2ADRB1GLSGBA1
SCHEMBL23807086 0.89 GBA1 (0.43) ADRB2ADRB1GBA1
SCHEMBL21106552 0.89 ADRB2 (0.44) ADRB2ADRB1GLSGBA1
SCHEMBL22861721 0.89 GLS (0.46) ADRB2ADRB1GLSGBA1
SCHEMBL23696408 0.86 ADRB2 (0.40) ADRB2ADRB1GLSGBA1
SCHEMBL22525949 0.86 GBA1 (0.43) ADRB2ADRB1GBA1
SCHEMBL22802142 0.85 NOTUM (0.44) NOTUMGLSGBA1
SCHEMBL23518630 0.83 GBA1 (0.43) NOTUMGLSGBA1
SCHEMBL24812463 0.82 GBA1 (0.53) NOTUMGLSGBA1
SCHEMBL22837782 0.81 GBA1 (0.42) ADRB2ADRB1GLSGBA1

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-11779578-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-10-10 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-11779578-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ADRB2 4578/4885ADRB1 4186/4885NOTUM 1368/4885

“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.