SCHEMBL13645674

SCHEMBL13645674

CC(=O)NC(C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
MAPT P10636 6/20 0.38
RECQL P46063 3/20 0.38
XBP1 P17861 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
NPSR1 Q6W5P4 4/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.36
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.36
DGAT1 O75907 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL24796325 1.00 CA12 (0.40) CA12CA14CA1CA2CA7
SCHEMBL22342115 0.92 NPSR1 (0.36) CA12CA14CA1CA2CA7
SCHEMBL22342114 0.92 NPSR1 (0.36) CA12CA14CA1CA2CA7
SCHEMBL23607312 0.83 CA1 (0.52) CA12CA14CA1CA2CA7
SCHEMBL23849248 0.83 CA1 (0.52) CA12CA14CA1CA2CA7
SCHEMBL1689249 0.83 CA1 (0.52) CA12CA14CA1CA2CA7
Acetic Acid SCHEMBL3898915 0.82 CA1 (0.47) CA12CA14CA1CA2CA7
SCHEMBL22688557 0.81 CA12 (0.42) CA12CA14CA1CA2CA7
SCHEMBL21549703 0.81 CA12 (0.42) CA12CA14CA1CA2CA7
SCHEMBL13985698 0.81 CA12 (0.39) CA12CA14CA1CA2CA7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598244-B2 [1,2,4]triazolo[1,5,a]pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-10-06 US disclosed
US-7598244-B2 [1,2,4]triazolo[1,5,a]pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-10-06 US disclosed
US-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-01-11 US disclosed
US-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-01-11 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-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof HLA-C, TPMT, TAP1 CA12 4076/4885CA14 2446/4885CA1 2191/4885

“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.