SCHEMBL3948769

SCHEMBL3948769

CC(C)(C)OC(=O)N1C[C@H](N)C[C@@H]1CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 11/20 0.40
BRD4 O60885 1/20 0.38
IDO1 P14902 1/20 0.37
KEAP1 Q14145 3/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL20783314 1.00 SRC (0.40) SRCBRD4IDO1KEAP1CYP1A2
SCHEMBL8572979 0.90 CYP1A2 (0.43) SRCBRD4IDO1CYP1A2POLB
SCHEMBL3947235 0.90 CYP1A2 (0.43) SRCBRD4IDO1CYP1A2POLB
SCHEMBL19674208 0.87 HSD17B10 (0.40) SRCBRD4IDO1HSD11B1
SCHEMBL3389544 0.86 JAK2 (0.38) SRCBRD4IDO1HSD11B1
SCHEMBL263737 0.86 JAK2 (0.38) SRCBRD4IDO1HSD11B1
SCHEMBL19540703 0.86 HSD11B1 (0.38) SRCBRD4IDO1HSD11B1
SCHEMBL7800302 0.84 ECE1 (0.37) SRCBRD4HSD11B1
SCHEMBL7807928 0.82 BRD4 (0.39) SRCBRD4HSD11B1
SCHEMBL3952747 0.82 BRD4 (0.39) SRCBRD4HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 US disclosed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 WO disclosed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 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-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE CTSB, CTSS, CTSF SRC 3768/4885BRD4 2317/4885IDO1 3335/4885

“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.