SCHEMBL13324201

SCHEMBL13324201

CC(C)(C)OC(=O)NO[11CH3]

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.46
CA12 O43570 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA2 P00918 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA1 P00915 2/20 0.39
CA7 P43166 2/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
APLNR P35414 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL487344 1.00 DGAT1 (0.46) DGAT1CA12CA14CA2TDP1
SCHEMBL30511197 0.83 TDP1 (0.37) DGAT1CA12CA14CA2TDP1
SCHEMBL20963156 0.80 MEN1 (0.47) DGAT1CA12CA14CA2TDP1
SCHEMBL24191656 0.79 DGAT1 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL191649 0.79 CA12 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL1927273 0.78 DGAT1 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL29422137 0.77 CA12 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL28026126 0.77 CA12 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL14182678 0.77 MEN1 (0.41) DGAT1CA12CA14CA2TDP1
SCHEMBL3685404 0.77 MAOA (0.46) DGAT1CA12CA14CA2TDP1

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-8367332-B2 Detection and quantification of abasic site formation in vivo CASE WESTERN RESERVE UNIVERSITY (US) 2013-02-05 US disclosed
US-20100111861-A1 DETECTION AND QUANTIFICATION OF ABASIC SITE FORMATION IN VIVO CASE WESTERN RESERVE UNIVERSITY 2010-05-06 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-20100111861-A1 DETECTION AND QUANTIFICATION OF ABASIC SITE FORMATION IN VIVO UNG, FEN1, DCLRE1B DGAT1 3651/4885CA12 1916/4885CA14 1473/4885

“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.