SCHEMBL13469276

SCHEMBL13469276

CCC[C@@H](CCCCO)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
CTSK P43235 15/20 0.46
CTSS P25774 2/20 0.46
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 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
SCHEMBL8288056 0.95 CTSK (0.47) TDP1CTSKCTSSCA1CA2
SCHEMBL29506103 0.90 CTSK (0.51) CTSKCTSS
SCHEMBL28523886 0.89 CTSK (0.50) CTSKCTSS
SCHEMBL30901642 0.89 CTSK (0.50) CTSKCTSS
SCHEMBL14279380 0.89 CTSK (0.56) CTSKCTSS
SCHEMBL18644348 0.89 CTSK (0.56) CTSKCTSS
SCHEMBL21660257 0.89 CTSK (0.49) TDP1CTSKCTSSCA1CA2
SCHEMBL9191203 0.89 CTSK (0.49) TDP1CTSKCTSSCA1CA2
SCHEMBL13669545 0.88 CTSK (0.54) CTSKCTSSCA1CA2CA7
SCHEMBL8042680 0.87 TDP1 (0.51) TDP1CTSKCTSSCA1CA2

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-20120264738-A1 DISPIROPYRROLIDINE DERIVATIVES SUGIMOTO YUUICHI (JP) 2012-10-18 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-20120264738-A1 DISPIROPYRROLIDINE DERIVATIVES MDM2, TP53, TP53BP1 TDP1 1524/4885CTSK 4518/4885CTSS 4406/4885

“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.