SCHEMBL23696205

SCHEMBL23696205

CC(S)CC(=O)NCCCCCOCCCCCOCC(=O)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 3/20 0.34
HPGD P15428 2/20 0.34
FAAH O00519 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
TP53 P04637 1/20 0.33
MEN1 O00255 1/20 0.33
CES2 O00748 1/20 0.32
CASP2 P42575 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
NCOR2 Q9Y618 1/20 0.32

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
SCHEMBL23945685 0.89 SMN1; SMN2 (0.44) EPHX2CYP2C19ALDH1A1HPGDFAAH
SCHEMBL21107578 0.87 MEN1 (0.44) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL25881862 0.85 MEN1 (0.39) EPHX2CYP2C19ALDH1A1HPGDFAAH
SCHEMBL22790738 0.84 MEN1 (0.52) EPHX2CYP2C19FAAHKMT2ATSHR
SCHEMBL22856128 0.82 MEN1 (0.53) EPHX2CYP2C19FAAHKMT2ARECQL
SCHEMBL24673572 0.82 CASP2 (0.54) EPHX2FAAHTSHRRECQLCASP2
SCHEMBL23945522 0.81 EPHX2 (0.36) EPHX2CYP2C19ALDH1A1FAAHSMN1; SMN2
SCHEMBL21106780 0.79 CYP2C19 (0.41) EPHX2CYP2C19ALDH1A1KMT2ATSHR
SCHEMBL23945272 0.79 KDM4E (0.53) EPHX2CYP2C19FAAHCES2
SCHEMBL18459570 0.79 CASP2 (0.41) EPHX2ALDH1A1HPGDFAAHSMN1; SMN2

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-20230190940-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-06-22 US disclosed
US-20210228562-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-07-29 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-20230190940-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 EPHX2 1890/4885CYP2C19 3990/4885ALDH1A1 2776/4885
US-20210228562-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 EPHX2 1890/4885CYP2C19 3990/4885ALDH1A1 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.