SCHEMBL24913317

SCHEMBL24913317

CCNC(=O)OC(C)(C)CCNC(=O)CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
CAPN1 P07384 1/20 0.37
CTSK P43235 1/20 0.36
KMT2A Q03164 3/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.32
ADRA1A P35348 2/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL19245438 0.80 SMN1; SMN2 (0.41) SMN1; SMN2TP53CTSKKMT2AGAA
SCHEMBL20144557 0.77 SMN1; SMN2 (0.40) SMN1; SMN2TP53CTSKKMT2AGAA
SCHEMBL19757979 0.76 KMT2A (0.51) SMN1; SMN2TP53CAPN1CTSKKMT2A
SCHEMBL24709963 0.75 TP53 (0.41) SMN1; SMN2TP53CTSKKMT2AGAA
SCHEMBL21034779 0.75 CHRNB2 (0.35) SMN1; SMN2CAPN1KMT2AGAAMEN1
SCHEMBL10224055 0.75 SMN1; SMN2 (0.49) SMN1; SMN2TP53KMT2AGAAMEN1
SCHEMBL24709967 0.74 TP53 (0.40) SMN1; SMN2TP53KMT2AGAAHPGD
SCHEMBL19176956 0.73 SMN1; SMN2 (0.47) SMN1; SMN2TP53KMT2AGAAMEN1
SCHEMBL19757995 0.73 KMT2A (0.57) SMN1; SMN2TP53CAPN1CTSKKMT2A
SCHEMBL1755576 0.72

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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-01-26 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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF POLRMT, NSUN2, NUDT1 SMN1; SMN2 1568/4885TP53 545/4885CAPN1 3017/4885

“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.