SCHEMBL3741129

SCHEMBL3741129

CC(C)(C)OC(=O)N1C(=O)CC2CCC(O)CC21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
PREP P48147 3/20 0.39
CYP3A4 P08684 10/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 2/20 0.36
THRB P10828 1/20 0.36
NR1H2 P55055 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
GPR119 Q8TDV5 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
SCHEMBL30918715 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL539900 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL30918718 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL20929429 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL3733352 0.82 CHRM2 (0.41) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL3733204 0.82 CHRM2 (0.41) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL20929165 0.78 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL5938340 0.75 CHRM2 (0.51) CHRM2CHRM1CHRM3PREPCYP3A4
SCHEMBL2198273 0.75 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL8107978 0.75 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242285-B2 N-tert-butoxycarbonyl-2-pyrrolidinones and production method thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed
US-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-25 US disclosed
EP-2008999-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PROCESS FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2008-12-31 EP 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 (2 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-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF TERT, CBR1, TELO2 CHRM2 1573/4885CHRM1 622/4885CHRM3 1930/4885
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof TERT, CBR1, TELO2 CHRM2 1573/4885CHRM1 622/4885CHRM3 1930/4885

“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.