SCHEMBL6826856

SCHEMBL6826856

CC(C)(C)OC(=O)NC1CCN([C]=O)C1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.76
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
HSD11B1 P28845 9/20 0.50
CYP2C9 P11712 1/20 0.50
BTK Q06187 2/20 0.46
KCNA3 P22001 1/20 0.43
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSH P09668 1/20 0.41
JAK3 P52333 1/20 0.41
EPHX1 P07099 1/20 0.40

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
SCHEMBL1307244 1.00 CTSK (0.76) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL14941684 0.91 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL7283644 0.91 CTSK (0.67) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL14349368 0.87 CTSK (1.00) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL14375421 0.87 CTSK (1.00) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL21803225 0.81 CTSK (0.52) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL458321 0.80 CTSK (0.83) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL428907 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL1959133 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9
SCHEMBL359644 0.80 CTSK (0.64) CTSKCA1CA2HSD11B1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140309192-A1 MODULATORS OF THE G PROTEIN-COUPLED MAS RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC, 2014-10-16 US claimed
US-20140309192-A1 MODULATORS OF THE G PROTEIN-COUPLED MAS RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC, 2014-10-16 US disclosed
US-20040067999-A1 Carbazole derivatives and their use as neuropeptide y5 receptor ligands ASTRAZENECA AB (SE) 2004-04-08 US disclosed
EP-1358157-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS AstraZeneca AB (SE) 2003-11-05 EP disclosed
WO-2002051806-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2002-07-04 WO 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 (2 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-20040067999-A1 Carbazole derivatives and their use as neuropeptide y5 receptor ligands NPY5R, NPY1R, NPY2R CTSK 728/4885CA1 1263/4885CA2 1117/4885
US-20140309192-A1 MODULATORS OF THE G PROTEIN-COUPLED MAS RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO MRGPRX1, MRGPRX2, AGTR1 CTSK 2078/4885CA1 1094/4885CA2 365/4885

“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.