SCHEMBL5200876

SCHEMBL5200876

CC(C)(C)OC(=O)NC1(C(=O)OC(C)(C)C)CC(CO)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
NR1H2 P55055 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CACNA1H O95180 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
EPHX1 P07099 1/20 0.33
APLNR P35414 1/20 0.33
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
GHSR Q92847 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
SCHEMBL7926354 0.92 KMT2A (0.38) KMT2AMEN1MAPK1NR1H2TDP1
SCHEMBL21946033 0.92 KMT2A (0.38) KMT2AMEN1MAPK1NR1H2TDP1
SCHEMBL19931893 0.88 KMT2A (0.36) KMT2AMEN1MAPK1NR1H2TDP1
SCHEMBL28396159 0.88 KMT2A (0.39) KMT2AMEN1MAPK1NR1H2TDP1
SCHEMBL1980398 0.83 MEN1 (0.43) KMT2AMEN1MAPK1CACNA1HHDAC4
SCHEMBL6254239 0.81 APLNR (0.33) KMT2AMEN1MAPK1NR1H2TDP1
SCHEMBL4966238 0.79 MEN1 (0.40) KMT2AMEN1MAPK1CACNA1HHDAC4
SCHEMBL1088267 0.79 MEN1 (0.40) KMT2AMEN1MAPK1CACNA1HHDAC4
SCHEMBL1088268 0.79 MEN1 (0.40) KMT2AMEN1MAPK1CACNA1HHDAC4
SCHEMBL1088079 0.79 MEN1 (0.40) KMT2AMEN1MAPK1CACNA1HHDAC4

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-7264792-B2 Solid phase preparation of 18F-labelled amino acids GE HEALTHCARE LIMITED (GB) 2007-09-04 US disclosed
EP-1572601-B1 SOLID-PHASE PREPARATION OF 18 F-LABELLED AMINO ACIDS GE HEALTHCARE LTD (GB) 2007-08-15 EP disclosed
US-20060039855-A1 Solid phase preparation of 18f-labelled amino acids GE HEALTHCARE LIMITED (GB) 2006-02-23 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 (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-20060039855-A1 Solid phase preparation of 18f-labelled amino acids SLC7A5, SLC43A1, SLCO2B1 KMT2A 1280/4885MEN1 1141/4885MAPK1 2305/4885

“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.