SCHEMBL20141013

SCHEMBL20141013

OCC1CNCCN1c1cc(F)c(F)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 0.47
SLC6A4 P31645 15/20 0.47
SLC6A3 Q01959 15/20 0.47
FPR2 P25090 1/20 0.40
SCN9A Q15858 1/20 0.40
HTR2C P28335 3/20 0.38
CYP2D6 P10635 7/20 0.36
HTR2B P41595 2/20 0.36
HTR2A P28223 1/20 0.36

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
SCHEMBL20129706 1.00 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3FPR2SCN9A
SCHEMBL20129705 0.86 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3HTR2CCYP2D6
SCHEMBL20140560 0.78 SLC6A4 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL21360403 0.78 SLC6A4 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL20141290 0.78 SLC6A4 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL24028174 0.76 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL20133720 0.76 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL20141556 0.76 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL22542019 0.75 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL22542021 0.75 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6

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