SCHEMBL4206111

SCHEMBL4206111

CC(C)C[C@H](OC(=O)N1CCC2OCC(=O)C21)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.52
CTSS P25774 6/20 0.49
CTSV O60911 4/20 0.49
CTSL P07711 3/20 0.49
MGLL Q99685 1/20 0.35
GRIN2B Q13224 1/20 0.34
CCR1 P32246 1/20 0.34
SLC6A3 Q01959 2/20 0.33

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
SCHEMBL4206106 1.00 CTSK (0.52) CTSKCTSSCTSVCTSLMGLL
SCHEMBL4201896 0.77 CTSK (0.59) CTSKCTSS
SCHEMBL4207288 0.77 CTSK (0.59) CTSKCTSS
SCHEMBL4201901 0.77 CTSK (0.59) CTSKCTSS
SCHEMBL13677296 0.77 CTSK (0.52) CTSKCTSSCTSVCTSL
SCHEMBL7148306 0.77 CTSK (0.52) CTSKCTSSCTSVCTSL
SCHEMBL4451293 0.77 CTSK (0.52) CTSKCTSSCTSVCTSL
SCHEMBL6808367 0.76 CTSK (0.80) CTSKCTSSCTSVCTSLCCR1
SCHEMBL13677133 0.76 CTSK (0.51) CTSKCTSSCTSVCTSL
SCHEMBL12828388 0.76 CTSK (0.80) CTSKCTSSCTSVCTSLCCR1

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-20090131502-A1 Biologically active compounds QUIBELL MARTIN 2009-05-21 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-20090131502-A1 Biologically active compounds COLGALT1, SOST, COL1A1 CTSK 116/4885CTSS 52/4885CTSV 146/4885

“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.