SCHEMBL25922601

SCHEMBL25922601

CC(C)CNC(=O)NCCOCCOCCNC[SH](S)S

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.32
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
MMP1 P03956 1/20 0.31
MMP8 P22894 1/20 0.31
EPHX2 P34913 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL22837658 0.86 EPHX1 (0.49) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL25700630 0.85 EPHX1 (0.45) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL23945307 0.83 EPHX1 (0.50) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL24765447 0.82 EPHX1 (0.53) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL26407268 0.81 EPHX1 (0.47) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL24673081 0.80 EPHX1 (0.49) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL24673552 0.79 MEN1 (0.53) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL21106046 0.78 KMT2A (0.56) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL23806970 0.77 MEN1 (0.46) EPHX1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL23695977 0.77 EPHX1 (0.50) EPHX1MEN1KMT2ACYP2D6CYP2C19

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 EPHX1 2677/4885MEN1 3175/4885KMT2A 1513/4885

“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.