SCHEMBL27917830

SCHEMBL27917830

CC(C)(C)NC(=O)OCCC1CNC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
NAAA Q02083 12/20 0.33
ASAH1 Q13510 2/20 0.33
EPHX1 P07099 1/20 0.33
GBA1 P04062 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 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
SCHEMBL27973837 0.89 EPHX1 (0.46) NAAAASAH1EPHX1
SCHEMBL27791277 0.85 ITGB3 (0.41) MEN1MAPTKMT2AATMEPHX1
SCHEMBL1367746 0.83 HDAC1 (0.38) MEN1MAPTKMT2AATMGBA1
Hydrochloric Acid SCHEMBL22291356 0.81 HDAC1 (0.38) MEN1MAPTKMT2AATMGBA1
SCHEMBL27802520 0.81 MEN1 (0.50) MEN1MAPTKMT2AATMNAAA
SCHEMBL27557065 0.80 MEN1 (0.37) MEN1MAPTKMT2AATMNAAA
Methane SCHEMBL27663317 0.79 MEN1 (0.36) MEN1MAPTKMT2AATMNAAA
SCHEMBL27973838 0.78 EPHX1 (0.45) NAAAASAH1EPHX1ITGB3ITGA2B
SCHEMBL28001382 0.75 SSTR4 (0.38)
SCHEMBL30223719 0.74 ALDH1A1 (0.40)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103068797-A Hexafluoroisopropyl carbamate derivatives, their preparation and their therapeutic application SANOFI SA 2013-04-24 CN disclosed