SCHEMBL6843350

SCHEMBL6843350

CC(C)(C)OC(=O)N[C@H](CC(=O)C1CNCCO1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 4/20 0.39
IDO1 P14902 1/20 0.38
CTSS P25774 5/20 0.37
CTSK P43235 5/20 0.37
PPARA Q07869 6/20 0.35
PPARG P37231 5/20 0.35
ACE P12821 1/20 0.35
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
PPARD Q03181 2/20 0.34
KLK7 P49862 1/20 0.34
KLK5 Q9Y337 1/20 0.34
ITGAV P06756 1/20 0.34
ITGB6 P18564 1/20 0.34

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
SCHEMBL31252251 0.81 IDO1 (0.43) IDO1CTSSCTSKPPARAPPARG
SCHEMBL8776174 0.80 SSTR4 (0.39) SSTR4CTSSCTSKCTSLCTSB
SCHEMBL8307743 0.79 CTSK (0.44) SSTR4CTSSCTSKCTSLCTSB
SCHEMBL7357403 0.76 CTSS (0.51) SSTR4CTSSCTSKACECTSL
SCHEMBL28908633 0.75 SSTR4 (0.41) SSTR4CTSSCTSKCTSLCTSB
SCHEMBL5870601 0.74 SSTR4 (0.41) SSTR4
SCHEMBL28695449 0.73 ITGB3 (0.48) CTSSCTSKACE
SCHEMBL31252212 0.73 CTSK (0.38) SSTR4IDO1CTSSCTSKCTSL
SCHEMBL9852723 0.72 SSTR4 (0.44) SSTR4
SCHEMBL28576006 0.71 SSTR4 (0.43) SSTR4

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-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 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-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates CD40, TNFRSF1A, CD2 SSTR4 2532/4885IDO1 235/4885CTSS 764/4885

“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.