SCHEMBL25833417

SCHEMBL25833417

CCC[C@@H](C)OC1CCN(CC(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.41
PIK3CD O00329 2/20 0.38
SIGMAR1 Q99720 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2D6 P10635 1/20 0.30

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
SCHEMBL25888110 0.90 HRH3 (0.40) HRH3PIK3CD
SCHEMBL25707430 0.90 HRH3 (0.40) HRH3PIK3CD
SCHEMBL23695835 0.88 HRH3 (0.42) HRH3PIK3CDSIGMAR1MEN1KMT2A
SCHEMBL25468942 0.88 HRH3 (0.42) HRH3PIK3CDSIGMAR1MEN1KMT2A
SCHEMBL23560055 0.88 HRH3 (0.42) HRH3PIK3CDSIGMAR1MEN1KMT2A
SCHEMBL25730402 0.85 HRH3 (0.39) HRH3PIK3CD
SCHEMBL24854497 0.80 HRH3 (0.42) HRH3MEN1KMT2ACYP2D6
SCHEMBL14706853 0.80 HRH3 (0.46) HRH3PIK3CDMEN1KMT2ACYP2D6
SCHEMBL24854302 0.79 KDM1A (0.34) HRH3
SCHEMBL25110223 0.78 HRH3 (0.43) HRH3PIK3CDSIGMAR1MEN1KMT2A

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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 US disclosed
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 (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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HRH3 3631/4885PIK3CD 321/4885SIGMAR1 3199/4885
US-20230219945-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HRH3 3631/4885PIK3CD 321/4885SIGMAR1 3199/4885

“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.