SCHEMBL13645938

SCHEMBL13645938

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

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.39
TRPV1 Q8NER1 1/20 0.33
MTNR1A P48039 3/20 0.31
MTNR1B P49286 3/20 0.31
ACACB O00763 6/20 0.31

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
SCHEMBL13645919 0.79 CTSK (0.40) CTSKMTNR1AMTNR1BACACB
SCHEMBL13645921 0.76 ACACB (0.36) TRPV1MTNR1AMTNR1BACACB
SCHEMBL13780653 0.71 ACACB (0.37) TRPV1MTNR1AMTNR1BACACB
SCHEMBL13645923 0.71 CTSK (0.42) CTSKTRPV1ACACB
SCHEMBL13780937 0.69 ACACB (0.36) TRPV1MTNR1AMTNR1BACACB
SCHEMBL13645924 0.66 TRPV1 (0.35) TRPV1MTNR1AMTNR1BACACB
SCHEMBL12506705 0.65 PAOX (0.38) TRPV1MTNR1AMTNR1BACACB
SCHEMBL19695796 0.64 CTSK (0.38) CTSK
SCHEMBL2736107 0.63 CHRNB2 (0.46) MTNR1AMTNR1BACACB
SCHEMBL18627874 0.63 ALOX15 (0.46) TRPV1MTNR1AMTNR1BACACB

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 CTSK 1560/4885TRPV1 524/4885MTNR1A 2091/4885

“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.