SCHEMBL7045324

SCHEMBL7045324

CC(C)(C)OC(=O)NC(C(=O)c1ccc(C#N)cc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 8/20 0.61
CTSK P43235 6/20 0.61
PRSS1 P07477 4/20 0.55
CTSG P08311 4/20 0.55
CTRB1 P17538 4/20 0.55
CMA1 P23946 4/20 0.55
S1PR4 O95977 1/20 0.46
S1PR3 Q99500 1/20 0.46
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
TRPA1 O75762 2/20 0.44
GABRB1 P18505 1/20 0.44
GABRB2 P47870 1/20 0.44
GSK3B P49841 1/20 0.41

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
SCHEMBL4264253 0.87 CTSK (0.61) CTSSCTSKS1PR3CTSLCTSB
SCHEMBL3645286 0.83 CTSS (0.57) CTSSCTSKPRSS1CTSGCTRB1
SCHEMBL7047114 0.81 CTSK (0.55) CTSSCTSKS1PR3GABRB1GABRB2
SCHEMBL20470112 0.81 TRPA1 (0.51) CTSSCTSKPRSS1CTSGCTRB1
SCHEMBL22506498 0.81 TRPA1 (0.51) CTSSCTSKPRSS1CTSGCTRB1
SCHEMBL23200865 0.81 CTSS (0.54) CTSSCTSKPRSS1CTSGCTRB1
SCHEMBL5041445 0.81 CTSS (0.71) CTSSCTSKCTSLCTSB
SCHEMBL5041450 0.81 CTSS (0.71) CTSSCTSKCTSLCTSB
SCHEMBL12849606 0.80 TRPA1 (0.50) CTSSCTSKPRSS1CTSGCTRB1
SCHEMBL14448525 0.80 CTSS (0.53) CTSSCTSKPRSS1CTSGCTRB1

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-20030083503-A1 Synthesis of acylated keto amides from sulfonyl amides FRANTZ DOUG E (US) 2003-05-01 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-20030083503-A1 Synthesis of acylated keto amides from sulfonyl amides AADAC, ACAA2, ACSS2 CTSS 1044/4885CTSK 1459/4885PRSS1 2026/4885

“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.