SCHEMBL23945701

SCHEMBL23945701

CC(C)CNCCCC(C)(C)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
CA2 P00918 1/20 0.31
PKM P14618 1/20 0.30
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 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
SCHEMBL22580318 0.92 HRH4 (0.38) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL15183474 0.82 HRH4 (0.36) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL21015515 0.78
SCHEMBL15183492 0.76 HRH4 (0.39) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL9624660 0.75 HRH4 (0.47) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL2478778 0.75 HRH4 (0.42) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL23696097 0.75 MEN1 (0.34) HRH4HRH3PKM
SCHEMBL16326390 0.75 L3MBTL1 (0.37)
SCHEMBL21015399 0.74 HRH4 (0.40) HRH4HRH3ALDH1A1CYP1A2CYP2C19
SCHEMBL21015249 0.74 HRH4 (0.40) HRH4HRH3ALDH1A1CYP1A2CYP2C19

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 HRH4 3886/4885HRH3 3631/4885ALDH1A1 2776/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 HRH4 3886/4885HRH3 3631/4885ALDH1A1 2776/4885

“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.