SCHEMBL146231

SCHEMBL146231

CC(C)(C)[Si](C)(C)O[C@H]1CN(C(=O)O)[C@](CO)(Cc2ccccc2)C1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 15/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL144300 0.92 GRIN2B (0.32) GRIN2BCHRM2CHRM4CHRM5CHRM1
SCHEMBL6319951 0.83 GRIN2B (0.39) GRIN2BALDH1A1LMNA
SCHEMBL146713 0.82 GRIN2B (0.33) GRIN2BALDH1A1LMNA
SCHEMBL141744 0.81 GRIN2B (0.32) GRIN2BALDH1A1LMNA
SCHEMBL16402974 0.81 GRIN2B (0.36) GRIN2BALDH1A1LMNA
SCHEMBL22776331 0.81 GAA (0.36) GRIN2B
SCHEMBL22776330 0.81 GAA (0.36) GRIN2B
SCHEMBL22776886 0.80 RORC (0.37)
SCHEMBL22776888 0.80 RORC (0.37)
SCHEMBL16401292 0.79 GRIN2B (0.39) GRIN2BALDH1A1LMNA

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-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2012-03-08 US disclosed
EP-2250171-A2 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS Achaogen, Inc. (US) 2010-11-17 EP disclosed
WO-2009137130-A2 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2009-11-12 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-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS RECQL, BLVRB, NQO2 GRIN2B 2496/4885CHRM2 915/4885CHRM4 1274/4885

“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.