SCHEMBL13409204

SCHEMBL13409204

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

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
KLK7 P49862 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
NR1H2 P55055 1/20 0.35
BCHE P06276 1/20 0.35
MAPK1 P28482 1/20 0.35
HPGD P15428 1/20 0.34

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
SCHEMBL4798184 0.91 USP2 (0.35) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL13391280 0.85 USP2 (0.36) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL483259 0.76 CHRM2 (0.43) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL20406585 0.76 CHRM2 (0.43) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL17986859 0.76 CHRM2 (0.40) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL22990242 0.76 CHRM2 (0.40) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL13864152 0.76 CHRM2 (0.40) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL21142612 0.76 CHRM2 (0.40) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL7609856 0.76 USP2 (0.35) USP2SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL24723669 0.75 CHRM2 (0.46) USP2SMN1; SMN2CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100099874-A1 TRANSANNULAR REARRANGEMENT OF ACTIVATED LACTAMS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS (FR) 2010-04-22 US disclosed
WO-2008125421-A1 TRANS-ANNULAR REARRANGEMENT OF ACTIVE LACTAMES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2008-10-23 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-20100099874-A1 TRANSANNULAR REARRANGEMENT OF ACTIVATED LACTAMS C9, RPS4Y1, C5 USP2 1997/4885SMN1; SMN2 3853/4885CHRM2 388/4885

“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.