SCHEMBL23453052

SCHEMBL23453052

CNCCCCC(CO)NC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CTSK P43235 8/20 0.40
CTSS P25774 2/20 0.38
ATM Q13315 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL23168272 0.89 TDP1 (0.59) TDP1MEN1GAAKMT2ACA1
SCHEMBL8062203 0.89 TDP1 (0.59) TDP1MEN1GAAKMT2ACA1
SCHEMBL10190369 0.89 TDP1 (0.59) TDP1MEN1GAAKMT2ACA1
SCHEMBL13040189 0.87 TDP1 (0.51) TDP1MEN1GAAKMT2ACA1
SCHEMBL8042680 0.87 TDP1 (0.51) TDP1MEN1GAAKMT2ACA1
SCHEMBL4811672 0.87 MEN1 (0.50) TDP1MEN1GAAKMT2ACA1
SCHEMBL24177101 0.86 CTSK (0.50) CTSKCTSS
SCHEMBL2296898 0.85 TDP1 (0.49) TDP1MEN1GAAKMT2ACA1
SCHEMBL28323890 0.85 TDP1 (0.49) TDP1MEN1GAAKMT2ACA1
SCHEMBL2296899 0.85 TDP1 (0.49) TDP1MEN1GAAKMT2ACA1

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-20210163541-A1 Method for Preparing PNA Oligomer SEASUNBIO MATERIALS (KR) 2021-06-03 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-20210163541-A1 Method for Preparing PNA Oligomer NCL, NOD1, POLI TDP1 775/4885MEN1 2705/4885GAA 1039/4885

“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.