SCHEMBL610149

SCHEMBL610149

CC(C)(C)C[C@H](CO)NC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
RIPK1 Q13546 1/20 0.31
TGFBR1 P36897 2/20 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
SCHEMBL13736040 1.00 GRN (0.33) GRNSORT1CYP3A4MAPK1RIPK1
SCHEMBL16330912 1.00 GRN (0.33) GRNSORT1CYP3A4MAPK1RIPK1
SCHEMBL4676146 0.83 CYP3A4 (0.30) CYP3A4MAPK1
SCHEMBL18980075 0.83 CYP3A4 (0.30) CYP3A4MAPK1
SCHEMBL15269870 0.83 CTSL (0.32) CYP3A4MAPK1
SCHEMBL4674996 0.83 CYP3A4 (0.30) CYP3A4MAPK1
SCHEMBL16654790 0.83 CYP3A4 (0.30) CYP3A4MAPK1
SCHEMBL3204238 0.83 CTSL (0.32) CYP3A4MAPK1
SCHEMBL15240384 0.83 CYP3A4 (0.31) CYP3A4MAPK1
SCHEMBL1861158 0.82 TGFBR1 (0.35) TGFBR1

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-20120040918-A9 PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID CTI BIO (KR) 2012-02-16 US disclosed
US-20110178031-A1 PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID CTI BIO (KR) 2011-07-21 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 (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-20120040918-A9 PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID SLC7A1, SLC29A1, SLC43A3 GRN 1883/4885SORT1 1126/4885CYP3A4 4822/4885
US-20110178031-A1 PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID SLC7A1, SLC29A1, SLC43A3 GRN 1883/4885SORT1 1126/4885CYP3A4 4822/4885

“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.