SCHEMBL13645754

SCHEMBL13645754

CC(=O)NC(C(=O)N1CCOCC1)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
PKM P14618 1/20 0.50
DPP4 P27487 1/20 0.46
DPP8 Q6V1X1 1/20 0.46
DPP9 Q86TI2 1/20 0.46
KMT2A Q03164 2/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
CCR1 P32246 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 2/20 0.41
ACACB O00763 1/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL14779934 0.86 SMN1; SMN2 (0.50) SMN1; SMN2PKMKMT2ACYP3A4CYP2C19
SCHEMBL13747805 0.84 DPP4 (0.53) DPP4DPP8DPP9KMT2ACYP3A4
SCHEMBL4464719 0.80 SMN1; SMN2 (0.41) SMN1; SMN2PKMKMT2ACYP3A4CYP2C19
SCHEMBL4464708 0.80 SMN1; SMN2 (0.41) SMN1; SMN2PKMKMT2ACYP3A4CYP2C19
SCHEMBL6443903 0.80 SMN1; SMN2 (0.44) SMN1; SMN2PKMDPP4DPP8DPP9
SCHEMBL23050302 0.79 CTSK (0.53) SMN1; SMN2PKMKMT2ATSHR
SCHEMBL7718204 0.77 SMN1; SMN2 (0.47) SMN1; SMN2PKMKMT2ACYP3A4CYP2C19
SCHEMBL21142539 0.77 SMN1; SMN2 (0.66) SMN1; SMN2PKMKMT2AHTT
SCHEMBL16580220 0.77 SMN1; SMN2 (0.66) SMN1; SMN2PKMKMT2AHTT
SCHEMBL26820888 0.76 CCR1 (0.61) PKMKMT2ACYP3A4CYP2C19CCR1

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 SMN1; SMN2 3178/4885PKM 2838/4885DPP4 316/4885

“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.