SCHEMBL20141678

SCHEMBL20141678

N#Cc1cc(F)ccc1N1CCC(NC(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.50
MTOR P42345 2/20 0.49
RPTOR Q8N122 2/20 0.49
MLST8 Q9BVC4 2/20 0.49
FFAR4 Q5NUL3 1/20 0.47
USP30 Q70CQ3 2/20 0.42
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
CTSC P53634 1/20 0.41

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
SCHEMBL21360311 0.83 RET (0.49) CHRM4DPP4CTSK
SCHEMBL16993975 0.82 GAA (0.52)
SCHEMBL31042527 0.81 DRD4 (0.51) CHRM4MTORRPTORMLST8USP30
SCHEMBL7716779 0.81 CHRM4 (0.47) CHRM4MTORRPTORMLST8FFAR4
SCHEMBL12836043 0.79 CTSK (0.52) DPP4CTSK
SCHEMBL20133586 0.79 MTOR (0.68) CHRM4MTORRPTORMLST8FFAR4
Hydrochloric Acid SCHEMBL20141665 0.78 MTOR (0.67) CHRM4MTORRPTORMLST8FFAR4
SCHEMBL12836527 0.77 MTOR (0.44) CHRM4MTORRPTORMLST8USP30
SCHEMBL20140959 0.77 MTOR (0.55) CHRM4MTORRPTORMLST8FFAR4
SCHEMBL21360337 0.76 CHRM4 (0.43) CHRM4FFAR4DPP4

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