SCHEMBL23945907

SCHEMBL23945907

C=C(NCCCCCCCCCCCC)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 12/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
CASP2 P42575 1/20 0.45
NAAA Q02083 1/20 0.42
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
FAAH O00519 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
PLA2G2A P14555 1/20 0.38

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
SCHEMBL23945509 1.00 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL20440154 1.00 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL19380753 0.98 EPHX1 (0.46) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL19966745 0.91 EPHX1 (0.41) EPHX1ZDHHC20ZDHHC2ADH1BADH1C
SCHEMBL26748968 0.88 ALDH1A1 (0.48) EPHX1ZDHHC20ZDHHC2CASP2ADH1B
SCHEMBL24063876 0.82 EPHX1 (0.45) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL23945983 0.81 KDM4E (0.33) EPHX1
SCHEMBL21991783 0.81 KDM4E (0.33) EPHX1
SCHEMBL23945710 0.81 KDM4E (0.33) EPHX1
SCHEMBL20647303 0.81 KDM4E (0.33) EPHX1

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 EPHX1 1684/4885ZDHHC20 2303/4885ZDHHC2 2616/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 EPHX1 1684/4885ZDHHC20 2303/4885ZDHHC2 2616/4885

“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.