SCHEMBL24672558

SCHEMBL24672558

CC(C)CCN1CCC2(CCC(NC(C)C)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 7/20 0.37
CYP1A2 P05177 1/20 0.35
ALOX15 P16050 1/20 0.35
ROCK2 O75116 2/20 0.33
ROCK1 Q13464 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
FPR3 P25089 3/20 0.32
FPR2 P25090 3/20 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
SCHEMBL24607256 0.86 CYP2D6 (0.36) CYP2D6CYP1A2ALOX15ROCK2ROCK1
SCHEMBL22856088 0.84 CYP2D6 (0.53) CYP2D6CYP1A2SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL25568027 0.83 ROCK2 (0.37) ROCK2ROCK1FPR3FPR2
SCHEMBL25480049 0.82 CYP2D6 (0.36) CYP2D6CYP1A2ALOX15SMN1; SMN2ALDH1A1
SCHEMBL23135139 0.79 CYP2D6 (0.41) CYP2D6CYP1A2ALOX15SMN1; SMN2ALDH1A1
SCHEMBL22477421 0.79 CYP2D6 (0.41) CYP2D6CYP1A2ALOX15SMN1; SMN2ALDH1A1
SCHEMBL23135133 0.78 CYP2D6 (0.40) CYP2D6CYP1A2SMN1; SMN2CYP3A4
SCHEMBL22477390 0.76 ALOX15 (0.42) CYP2D6CYP1A2ALOX15SMN1; SMN2
SCHEMBL22477401 0.76 CYP2D6 (0.41) CYP2D6CYP1A2ALOX15SMN1; SMN2ALDH1A1
SCHEMBL24784256 0.75 ROCK2 (0.39) CYP1A2ROCK2ROCK1ALDH1A1CYP3A4

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-20220340570-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-27 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-20220340570-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CYP2D6 3599/4885CYP1A2 3570/4885ALOX15 3105/4885

“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.