SCHEMBL20141312

SCHEMBL20141312

CC(C)N1CCN(C(=O)O)C[C@H]1CO

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TACR1 P25103 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.31
CHRM3 P20309 1/20 0.31
POLB P06746 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
PIK3CD O00329 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
SCHEMBL28719857 0.86 PARP1 (0.37) MEN1KMT2APKMPOLBL3MBTL1
SCHEMBL28719855 0.86 PARP1 (0.37) MEN1KMT2APKMPOLBL3MBTL1
SCHEMBL20314864 0.82 JAK3 (0.34) MEN1KMT2APKM
SCHEMBL25839519 0.82 JAK3 (0.34) MEN1KMT2APKM
SCHEMBL25738592 0.79 PKM (0.33) PKMPOLBL3MBTL1
SCHEMBL26551530 0.79 NR1H2 (0.48) MEN1KMT2AMAPK1L3MBTL1HRH3
SCHEMBL27031176 0.77 PIK3CD (0.39) MEN1KMT2ATACR1CHRM3POLB
SCHEMBL27230523 0.77 TACR1 (0.39) TACR1POLBL3MBTL1PIK3CD
SCHEMBL27209164 0.77 TACR1 (0.39) TACR1POLBL3MBTL1PIK3CD
SCHEMBL27133377 0.77 PIK3CD (0.39) MEN1KMT2ATACR1CHRM3POLB

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
EP-3538091-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF Navitor Pharmaceuticals, Inc. (US) 2019-09-18 EP disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed