SCHEMBL4748046

SCHEMBL4748046

CC(C)(C)OC(=O)C12CCCC1CNC2=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
MAPK1 P28482 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL4748083 0.70 MAPK1 (0.31) MAPK1
SCHEMBL4748100 0.68 CYP3A4 (0.31) MAPK1
SCHEMBL27474923 0.66 DDB1 (0.32) DDB1CRBN
SCHEMBL4748053 0.66 GAA (0.31) DDB1CRBNMAPK1
SCHEMBL20054555 0.65 CYP3A4 (0.44) MAPK1MAPT
SCHEMBL25287796 0.64 MAPT (0.45) MAPT
SCHEMBL30107576 0.64 DDB1 (0.32) DDB1CRBNMAPK1
SCHEMBL27637472 0.62 DGAT1 (0.38)
SCHEMBL14699482 0.62
SCHEMBL28838413 0.62 CCR2 (0.31)

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-20140142096-A1 Fused Substituted Aminopyrrolidine Derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-05-22 US disclosed
US-20130029977-A9 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2013-01-31 US disclosed
US-20120108582-A1 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2012-05-03 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 (3 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-20120108582-A1 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 DDB1 1809/4885CRBN 2809/4885MAPK1 2614/4885
US-20140142096-A1 Fused Substituted Aminopyrrolidine Derivative NQO2, QDPR, IL4I1 DDB1 1809/4885CRBN 2809/4885MAPK1 2614/4885
US-20130029977-A9 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 DDB1 1809/4885CRBN 2809/4885MAPK1 2614/4885

“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.