SCHEMBL15216896

SCHEMBL15216896

O=C1NC(=O)[C@]2(C[C@@H](CI)C2)N1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PYGM P11217 1/20 0.38
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.31
CRBN Q96SW2 1/20 0.31
AKR1B1 P15121 1/20 0.31

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
SCHEMBL15219088 1.00 PYGM (0.38) PYGMTDP1LMNACRBNAKR1B1
SCHEMBL15216893 0.82 LMNA (0.37) PYGMTDP1LMNACRBNAKR1B1
SCHEMBL15219049 0.81 CRBN (0.36) TDP1CRBN
SCHEMBL15014721 0.81 CRBN (0.36) TDP1CRBN
SCHEMBL15216897 0.80 PYGM (0.45) PYGMTDP1CRBN
SCHEMBL18133096 0.80 PYGM (0.45) PYGMTDP1CRBN
SCHEMBL21150675 0.74 CRBN (0.37) PYGMCRBNAKR1B1
SCHEMBL15219087 0.70 TDP1 (0.40) TDP1LMNACRBN
SCHEMBL17057390 0.69 GAA (0.40) TDP1LMNACRBN
SCHEMBL15216895 0.69 GAA (0.40) TDP1LMNACRBN

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
EP-2602261-B1 BORON COMPOUND WITH AMINO ACID SKELETON CONTAINING CYCLIC RING STELLA PHARMA CORP (JP) 2016-10-12 EP disclosed
US-8907128-B2 Boron compound with amino acid skeleton containing cyclo ring-type ring STELLA PHARMA CORPORATION (JP) 2014-12-09 US disclosed
US-8907128-B2 Boron compound with amino acid skeleton containing cyclo ring-type ring STELLA PHARMA CORPORATION (JP) 2014-12-09 US disclosed
US-20130225861-A1 Boron Compound With Amino Acid Skeleton Containing Cyclo Ring STELLA PHARMA CORPORATION (JP) 2013-08-29 US disclosed
US-20130225861-A1 Boron Compound With Amino Acid Skeleton Containing Cyclo Ring STELLA PHARMA CORPORATION (JP) 2013-08-29 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-20130225861-A1 Boron Compound With Amino Acid Skeleton Containing Cyclo Ring BCAT1, BCAT2, SLC1A5 PYGM 2441/4885TDP1 3968/4885LMNA 1322/4885

“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.