SCHEMBL4540392

SCHEMBL4540392

CC(CO)N(C(=O)OC(C)(C)C)c1cccc(Br)n1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.34
HTR1A P08908 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
CLK1 P49759 1/20 0.32
AAK1 Q2M2I8 2/20 0.32
USP30 Q70CQ3 1/20 0.32
BACE1 P56817 1/20 0.31
SLC7A5 Q01650 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTR7 P34969 1/20 0.31
PAX8 Q06710 1/20 0.31
TRPV3 Q8NET8 1/20 0.31
GRM2 Q14416 1/20 0.30

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
SCHEMBL10261793 0.87 USP30 (0.39) SSTR4HTR1AIRAK4CLK1AAK1
SCHEMBL4539730 0.86 LMNA (0.34) USP30SLC7A5GRM2
SCHEMBL14558308 0.79 SSTR4 (0.35) SSTR4IRAK4AAK1GRM2
SCHEMBL15240728 0.79 GBA1 (0.39) SSTR4AAK1USP30BACE1
SCHEMBL943797 0.78 SSTR4 (0.37) SSTR4HTR1AIRAK4CLK1BACE1
SCHEMBL2171679 0.77 AAK1 (0.38) AAK1
SCHEMBL68085 0.76 PAX8 (0.42) SSTR4HTR1AIRAK4CLK1BACE1
SCHEMBL1134230 0.75 SMN1; SMN2 (0.43) AAK1
SCHEMBL3288030 0.75 SMN1; SMN2 (0.43) AAK1
SCHEMBL6832915 0.74 SMN1; SMN2 (0.40) PAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49735-E1 Oxazolidinones as modulators of MGLUR5 BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-28 US disclosed
EP-2638022-B1 OXAZOLIDINONES AS MODULATORS OF MGLUR5 BRISTOL MYERS SQUIBB CO (US) 2014-12-24 EP disclosed
EP-2638022-A1 OXAZOLIDINONES AS MODULATORS OF MGLUR5 Bristol-Myers Squibb Company (US) 2013-09-18 EP disclosed
US-20120283264-A1 Oxazolidinones as Modulators of MGLUR5 BRISTOL-MYERS SQUIBB COMPANY 2012-11-08 US disclosed
WO-2012064603-A1 OXAZOLIDINONES AS MODULATORS OF MGLUR5 BRISTOL-MYERS SQUIBB COMPANY (US) 2012-05-18 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-20120283264-A1 Oxazolidinones as Modulators of MGLUR5 GRM5, GRIK5, GRM1 SSTR4 642/4885HTR1A 284/4885IRAK4 819/4885

“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.