SCHEMBL4229779

SCHEMBL4229779

CC(C)(C)OC(=O)C(=O)N1CCC[C@H]1C(=O)NNC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 5/20 0.57
NPSR1 Q6W5P4 1/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
TSHR P16473 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CMA1 P23946 1/20 0.48
CTSK P43235 1/20 0.47
GFER P55789 1/20 0.47
CTRB1 P17538 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA2B P29275 1/20 0.47
ADORA1 P30542 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL4229783 1.00 FKBP1A (0.57) FKBP1ANPSR1KMT2AMEN1TSHR
SCHEMBL4228972 0.90 KMT2A (0.59) FKBP1ANPSR1KMT2AMEN1TSHR
SCHEMBL4228978 0.90 KMT2A (0.59) FKBP1ANPSR1KMT2AMEN1TSHR
SCHEMBL4219015 0.89 FKBP1A (0.71) FKBP1ANPSR1KMT2AMEN1TSHR
SCHEMBL4219005 0.89 FKBP1A (0.71) FKBP1ANPSR1KMT2AMEN1TSHR
SCHEMBL4654349 0.87 FKBP1A (0.57) FKBP1ANPSR1KMT2ATSHRL3MBTL1
SCHEMBL4654345 0.87 FKBP1A (0.57) FKBP1ANPSR1KMT2ATSHRL3MBTL1
SCHEMBL4220901 0.84 KMT2A (0.46) FKBP1ANPSR1KMT2AMEN1LMNA
SCHEMBL4220908 0.84 KMT2A (0.46) FKBP1ANPSR1KMT2AMEN1LMNA
SCHEMBL16611343 0.84 CTRB1 (0.54) FKBP1ANPSR1KMT2AMEN1TSHR

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-20090105091-A1 Modified Amino Acids TECHNISCHE UNIVERSITAT WIEN (AT) 2009-04-23 US disclosed
EP-1826199-A1 Modified amino acids Technische Universität Wien (AT) 2007-08-29 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 (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-20090105091-A1 Modified Amino Acids SLC1A2, NR1H4, OXGR1 FKBP1A 191/4885NPSR1 214/4885KMT2A 1541/4885

“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.