SCHEMBL21716644

SCHEMBL21716644

BNC(=O)[C@H](C)NC(=O)NCCNCCCCCCS

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.39
TSHR P16473 2/20 0.33
EPHX2 P34913 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HDAC3 O15379 2/20 0.31
HDAC4 P56524 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC7 Q8WUI4 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC10 Q969S8 2/20 0.31
HDAC11 Q96DB2 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31
HDAC9 Q9UKV0 2/20 0.31
HDAC5 Q9UQL6 2/20 0.31

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
SCHEMBL20962328 0.87 EPHX1 (0.46) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL20962292 0.87 EPHX1 (0.46) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL20962291 0.86 EPHX1 (0.42) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL25919981 0.84 EPHX1 (0.41) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL17080653 0.84 HDAC4 (0.39) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL22386550 0.83 EPHX1 (0.41) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL807923 0.83 EPHX1 (0.41) EPHX1TSHREPHX2SMN1; SMN2MEN1
SCHEMBL25919987 0.74 MAPT (0.40) EPHX1EPHX2MEN1KMT2A
SCHEMBL25919983 0.73 EPHX1 (0.36) EPHX1EPHX2HDAC3HDAC4HDAC1
SCHEMBL22386546 0.73 MAPT (0.39) EPHX1MEN1KMT2A

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-20200046725-A1 Prodrug Comprising a Drug Linker Conjugate ASCENDIS PHARMA A/S (DK) 2020-02-13 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-20200046725-A1 Prodrug Comprising a Drug Linker Conjugate H1-0, H1-3, H1-2 EPHX1 1697/4885TSHR 994/4885EPHX2 1085/4885

“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.