SCHEMBL5238941

SCHEMBL5238941

CC(C)(C)OC(=O)NC1(C2CCNC2)CC(F)C1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.32
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
BTK Q06187 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
SCHEMBL8570166 0.86 KMT2A (0.35) MEN1MAPK1KMT2AGAABTK
SCHEMBL2082309 0.86 KMT2A (0.35) MEN1MAPK1KMT2AGAABTK
SCHEMBL2082308 0.86 KMT2A (0.35) MEN1MAPK1KMT2AGAABTK
SCHEMBL5231750 0.84 MEN1 (0.32) MEN1MAPK1KMT2AGAABTK
SCHEMBL2082222 0.84 PSEN1 (0.36) MEN1MAPK1KMT2AGAABTK
SCHEMBL2082224 0.84 PSEN1 (0.36) MEN1MAPK1KMT2AGAABTK
Oxalic Acid SCHEMBL2267135 0.83 BTK (0.33) MEN1MAPK1KMT2AGAABTK
SCHEMBL4748874 0.79 MEN1 (0.37) MEN1MAPK1KMT2AGAADPP8
SCHEMBL2670376 0.79 MEN1 (0.37) MEN1MAPK1KMT2AGAADPP8
SCHEMBL25370190 0.78 PSEN1 (0.34) MEN1MAPK1KMT2AGAABTK

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
EP-0990654-B1 SUBSTITUTED CYCLOBUTYLAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2007-11-14 EP disclosed
US-6448266-B1 COMPOUNDS SUCH AS 2-AMINO-7-(3-(3-AMINO-1-FLUOROCYCLOBUTAN-3-YL)PYRROLIDIN-1-YL)-6-FLUORO-1-(2-FLUORO-1-CYCLOPROPYL)-8-METHYL-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLIC ACID; ANTIBACTERIAL ACTIVITY; STAPHYLOCOCCUS, PNEUMOCOCCUS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-09-10 US disclosed
EP-0990654-A1 SUBSTITUTED CYCLOBUTYLAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed