SCHEMBL25828289

SCHEMBL25828289

CCCCCN1CCO[C@@H](COCCC)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 3/20 0.46
ALDH1A1 P00352 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
EPHA2 P29317 5/20 0.39
KDR P35968 4/20 0.39
EPHB4 P54760 4/20 0.39
SIGMAR1 Q99720 2/20 0.38
EBP Q15125 1/20 0.38
HRH3 Q9Y5N1 2/20 0.36
MAPK1 P28482 2/20 0.36
CYP1A2 P05177 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
HTR2A P28223 1/20 0.36
SCN1A P35498 1/20 0.36
HTR2B P41595 1/20 0.36
KCNH2 Q12809 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 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
SCHEMBL29762063 0.89 PDK1 (0.43) PDK1ALDH1A1TDP1SMN1; SMN2HRH3
SCHEMBL26621765 0.89 PDK1 (0.41) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL25123425 0.88 ALDH1A1 (0.53) PDK1ALDH1A1TDP1SMN1; SMN2HRH3
SCHEMBL22837616 0.87 PDK1 (0.41) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL26403991 0.87 PDK1 (0.41) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL25468939 0.87 PDK1 (0.53) PDK1ALDH1A1TDP1SMN1; SMN2SIGMAR1
SCHEMBL26280853 0.85 PDK1 (0.51) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL26280856 0.85 PDK1 (0.51) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL24379939 0.85 ALDH1A1 (0.40) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2
SCHEMBL24508737 0.85 PDK1 (0.43) PDK1ALDH1A1TDP1SMN1; SMN2EPHA2

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-20230219945-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-13 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-20230219945-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PDK1 504/4885ALDH1A1 2776/4885TDP1 236/4885

“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.