SCHEMBL16286191

SCHEMBL16286191

COC[C@H](CCCNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
GAA P10253 1/20 0.59
TDP1 Q9NUW8 2/20 0.50
CA1 P00915 7/20 0.46
CA2 P00918 7/20 0.46
CA12 O43570 6/20 0.46
CA9 Q16790 6/20 0.46
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
SYK P43405 1/20 0.39
CTSK P43235 3/20 0.39
CTSS P25774 2/20 0.39
STK17B O94768 1/20 0.39
STK17A Q9UEE5 1/20 0.39
CAPN1 P07384 1/20 0.39
CA7 P43166 1/20 0.39
ATM Q13315 1/20 0.38
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL13405019 0.96 MEN1 (0.54) MEN1KMT2AGAATDP1CA1
SCHEMBL16285824 0.91 MEN1 (0.50) MEN1KMT2AGAATDP1CA1
SCHEMBL6244166 0.85 MEN1 (0.62) MEN1KMT2AGAATDP1CA1
SCHEMBL12666362 0.85 MEN1 (0.62) MEN1KMT2AGAATDP1CA1
SCHEMBL19301024 0.85 MEN1 (0.62) MEN1KMT2AGAATDP1CA1
SCHEMBL24075383 0.85 TDP1 (0.45) MEN1KMT2AGAATDP1CA1
SCHEMBL24075378 0.85 SYK (0.41) MEN1KMT2AGAACA1CA2
SCHEMBL7730493 0.85 MEN1 (0.62) MEN1KMT2AGAATDP1CA1
SCHEMBL14309092 0.85 MEN1 (0.51) MEN1KMT2AGAATDP1CA1
SCHEMBL13405015 0.84 TDP1 (0.47) MEN1KMT2AGAATDP1CA1

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-9371274-B2 Compound having read-through activity THE UNIVERSITY OF TOKYO (JP) 2016-06-21 US disclosed
US-20140364642-A1 COMPOUND HAVING READ-THROUGH ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2014-12-11 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-20140364642-A1 COMPOUND HAVING READ-THROUGH ACTIVITY UPF1, NUDT21, GBA2 MEN1 1290/4885KMT2A 2365/4885GAA 7/4885

“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.