SCHEMBL3757945

SCHEMBL3757945

CC(O)C(CCc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.58
CTSS P25774 3/20 0.58
KLK5 Q9Y337 2/20 0.52
ATM Q13315 1/20 0.50
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.47
APP P05067 1/20 0.47
ACE P12821 1/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
PSEN1 P49768 2/20 0.45
PSEN2 P49810 2/20 0.45

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
SCHEMBL3757948 1.00 CTSK (0.58) CTSKCTSSKLK5ATMCTSL
SCHEMBL3722338 1.00 CTSK (0.58) CTSKCTSSKLK5ATMCTSL
SCHEMBL15316224 0.92 CTSK (0.53) CTSKCTSSKLK5ATMCTSL
SCHEMBL3841362 0.88 CTSK (0.57) CTSKCTSSKLK5ATMCTSL
SCHEMBL27640245 0.88 CTSK (0.57) CTSKCTSSKLK5ATMCTSL
SCHEMBL5850035 0.88 CTSK (0.57) CTSKCTSSKLK5ATMCTSL
SCHEMBL18653928 0.88 CTSK (0.57) CTSKCTSSKLK5ATMCTSL
SCHEMBL13986001 0.87 CTSK (0.56) CTSKCTSSKLK5ATMCTSL
SCHEMBL1759943 0.87 CTSK (0.49) CTSKCTSSKLK5MEN1KMT2A
SCHEMBL1759946 0.87 CTSK (0.49) CTSKCTSSKLK5MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311798-A1 2-AMINOOXAZOLINES AS TAAR1 LIGANDS HOFFMANN-LA ROCHE, INC. 2010-12-09 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-20100311798-A1 2-AMINOOXAZOLINES AS TAAR1 LIGANDS TAAR1, TAAR5, NPY2R CTSK 2354/4885CTSS 3355/4885KLK5 3878/4885

“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.