SCHEMBL15908108

SCHEMBL15908108

CC(C)(C)OC(=O)N[C@]1(C)C[C@H](C)C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
BTK Q06187 1/20 0.35
GAA P10253 3/20 0.35
EPHX2 P34913 1/20 0.35
HCRTR2 O43614 1/20 0.35
CTSK P43235 1/20 0.34
CACNA1H O95180 1/20 0.34
RORC P51449 1/20 0.33
APLNR P35414 1/20 0.33
EPHX1 P07099 1/20 0.33

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
SCHEMBL15306517 1.00 MEN1 (0.44) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL15306518 0.85 MEN1 (0.44) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL23562282 0.84 MEN1 (0.43) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL25126862 0.84 MEN1 (0.43) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL29049022 0.84 MEN1 (0.43) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL26342483 0.82 MEN1 (0.42) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL2087734 0.80 RORC (0.43) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL23208961 0.80 KMT2A (0.40) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL20799595 0.80 MEN1 (0.40) MEN1MAPK1KMT2ANFKB1NFKB2
SCHEMBL23208962 0.80 KMT2A (0.40) MEN1MAPK1KMT2ANFKB1NFKB2

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-9381259-B2 Precursor compound of radioactive halogen-labeled organic compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2016-07-05 US disclosed
US-20160082135-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDI-PHYSICS CO., LTD. (JP) 2016-03-24 US disclosed
US-20160000944-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDI-PHYSICS CO., LTD. (JP) 2016-01-07 US disclosed
US-20140213817-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON-MEDI-PHYSICS CO., LTD. (JP) 2014-07-31 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-20140213817-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND BCAT2, SLCO2B1, ORC3 MEN1 3670/4885MAPK1 1499/4885KMT2A 3576/4885
US-20160082135-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND BCAT2, SLCO2B1, ORC3 MEN1 3670/4885MAPK1 1499/4885KMT2A 3576/4885
US-20160000944-A1 PRECURSOR COMPOUND OF RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND BCAT2, SLCO2B1, ORC3 MEN1 3670/4885MAPK1 1499/4885KMT2A 3576/4885

“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.