SCHEMBL3728463

SCHEMBL3728463

CC(C)(C)OC(=O)NC1CC(=O)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.46
GAA P10253 1/20 0.44
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
BTK Q06187 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
HSD11B1 P28845 2/20 0.41
CYP2C9 P11712 1/20 0.41
EPHX2 P34913 1/20 0.40
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.38
EPHX1 P07099 1/20 0.38
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL3735790 0.88 MEN1 (0.38) CTSKNFKB1NFKB2RELAKMT2A
SCHEMBL13108624 0.81 CTSK (0.48) CTSKGAANFKB1NFKB2RELA
SCHEMBL18889434 0.81 CTSK (0.48) CTSKGAANFKB1NFKB2RELA
SCHEMBL31248177 0.81 CTSK (0.48) CTSKGAANFKB1NFKB2RELA
SCHEMBL3736668 0.80 ALDH1A1 (0.49) CTSKGAACA1CA2HSD11B1
SCHEMBL3735901 0.80 USP30 (0.51) CTSKKMT2AMEN1CHRM1
SCHEMBL13108631 0.78 CTSK (0.45) CTSKGAANFKB1NFKB2RELA
SCHEMBL25872146 0.78 MAPT (0.47) CTSKGAANFKB1NFKB2RELA
SCHEMBL7003843 0.77 EPHX2 (0.54) EPHX2KMT2AL3MBTL1KDM1AMAOB
SCHEMBL26984197 0.76 CHRM2 (0.42) HSD11B1KMT2AMEN1CHRM2CHRM1

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 CTSK 4477/4885GAA 4820/4885NFKB1 1335/4885
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof TERT, CBR1, TELO2 CTSK 4477/4885GAA 4820/4885NFKB1 1335/4885

“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.