SCHEMBL4394493

SCHEMBL4394493

CC(C)[C@H](C=O)NC(=O)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.56
ELANE P08246 2/20 0.55
CTSB P07858 3/20 0.54
CTSK P43235 4/20 0.53
CTRB1 P17538 2/20 0.52
PRTN3 P24158 2/20 0.52
CTSS P25774 4/20 0.51
CTSL P07711 3/20 0.51
PSMB1 P20618 1/20 0.51
PSMB5 P28074 1/20 0.51
PSMB2 P49721 1/20 0.51

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
SCHEMBL2228854 1.00 ATM (0.56) ATMELANECTSBCTSKCTRB1
SCHEMBL4394496 1.00 ATM (0.56) ATMELANECTSBCTSKCTRB1
SCHEMBL7279908 0.91 ELANE (0.48) ATMELANECTSBCTSKCTRB1
SCHEMBL7807991 0.90 CASP3 (0.59) CTSBCTSKCTSSCTSL
SCHEMBL7807995 0.90 CASP3 (0.59) CTSBCTSKCTSSCTSL
SCHEMBL7307323 0.87 CTSL (0.58) ATMELANECTSBCTSKCTRB1
SCHEMBL14341586 0.87 CTSL (0.63) CTSBCTSKCTSSCTSL
SCHEMBL22754646 0.87 ATM (0.54) ATMELANECTSBCTSKCTRB1
SCHEMBL1844644 0.86 CTSK (0.69) CTSBCTSKCTSSCTSLPSMB1
SCHEMBL24187715 0.85 ATM (0.58) ATMELANECTSBCTSKCTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 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 (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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 ATM 3418/4885ELANE 614/4885CTSB 397/4885

“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.