SCHEMBL23945623

SCHEMBL23945623

CC(=O)Nc1cnn(C2CCC(I)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.50
CLK2 P49760 5/20 0.42
LRRK2 Q5S007 4/20 0.42
GSK3B P49841 2/20 0.37
DYRK1A Q13627 2/20 0.37
CLK3 P49761 1/20 0.37
MAPK7 Q13164 2/20 0.37
ACHE P22303 3/20 0.37
JAK1 P23458 2/20 0.36
JAK3 P52333 2/20 0.36
NAMPT P43490 1/20 0.36
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMYD3 Q9H7B4 1/20 0.36
JAK2 O60674 1/20 0.36
DDB1 Q16531 1/20 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
SCHEMBL4285440 0.87 OGA (0.53) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL19296123 0.83 DDB1 (0.52) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL19296121 0.82 OGA (0.54) OGACLK2LRRK2GSK3BDYRK1A
Hydrochloric Acid SCHEMBL19283848 0.82 DDB1 (0.51) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL19283852 0.81 OGA (0.53) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL23945144 0.80 OGA (0.46) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL23945349 0.80 OGA (0.46) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL22098019 0.79 OGA (0.44) OGACLK2LRRK2GSK3BDYRK1A
Hydrochloric Acid SCHEMBL21640209 0.78 OGA (0.46) OGACLK2LRRK2GSK3BDYRK1A
SCHEMBL23806650 0.77 OGA (0.44) OGACLK2LRRK2GSK3BDYRK1A

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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 OGA 839/4885CLK2 1819/4885LRRK2 606/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 OGA 839/4885CLK2 1819/4885LRRK2 606/4885

“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.