SCHEMBL23945606

SCHEMBL23945606

CCOCC1CCN(CC(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.40
PIK3CD O00329 2/20 0.36
HTR2A P28223 4/20 0.33
HTR2C P28335 4/20 0.33
HTR2B P41595 4/20 0.33
SIGMAR1 Q99720 4/20 0.33
DRD2 P14416 1/20 0.33
CYP2D6 P10635 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL22856073 0.84 SMN1; SMN2 (0.41) HRH3PIK3CDHTR2AHTR2CHTR2B
SCHEMBL23696290 0.83 ALDH1A1 (0.41) HRH3HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL25071623 0.81 HRH3 (0.42) HRH3PIK3CDCYP2D6SMN1; SMN2KDM4E
SCHEMBL10151225 0.81 PIK3CD (0.42) PIK3CD
SCHEMBL26741833 0.81 HRH3 (0.38) HRH3PIK3CDCYP2D6ALDH1A1
SCHEMBL21107631 0.81 DRD2 (0.39) HRH3PIK3CDHTR2AHTR2CHTR2B
SCHEMBL24508530 0.80 DRD2 (0.38) HRH3PIK3CDHTR2AHTR2CHTR2B
SCHEMBL22309866 0.79 HRH3 (0.41) HRH3PIK3CDCYP2D6SMN1; SMN2KDM4E
SCHEMBL23696529 0.79 HRH3 (0.41) HRH3PIK3CDCYP2D6SMN1; SMN2KDM4E
SCHEMBL22526285 0.78 CARM1 (0.40) HRH3PIK3CDHTR2AHTR2CHTR2B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) 2023-07-27 US disclosed
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 (3 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-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF IRAK4, IRAK2, IRAK1 HRH3 3945/4885PIK3CD 421/4885HTR2A 4667/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 HRH3 3631/4885PIK3CD 321/4885HTR2A 3621/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HRH3 3631/4885PIK3CD 321/4885HTR2A 3621/4885

“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.