SCHEMBL20141349

SCHEMBL20141349

C[C@H]1CN(C(=O)O)CCN1c1ncccc1S(N)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMO Q99835 13/20 0.45
SLC6A7 Q99884 1/20 0.45
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRM1 Q13255 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 1/20 0.38
MTOR P42345 1/20 0.38
RPTOR Q8N122 1/20 0.38
MLST8 Q9BVC4 1/20 0.38

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
SCHEMBL20129661 0.86 SMARCA2 (0.51) SMOGRM1
SCHEMBL20141823 0.86 SMARCA2 (0.51) SMOGRM1
SCHEMBL20140927 0.79 CA1 (0.47) KMT2AMTORRPTORMLST8
SCHEMBL20140997 0.77 GRM1 (0.47) SMOSLC6A7GRM1
SCHEMBL20141187 0.77 SMO (0.45) SMOSLC6A7GRM1SMN1; SMN2KMT2A
SCHEMBL20140940 0.75 HTR2A (0.48) LMNAHTTSMN1; SMN2KMT2AMTOR
SCHEMBL20129660 0.75 HTR2A (0.48) LMNAHTTSMN1; SMN2KMT2AMTOR
SCHEMBL20140855 0.74 GRM1 (0.67) SMOSLC6A7GRM1SMN1; SMN2
SCHEMBL3119867 0.74 SLC6A7 (0.43) SMOSLC6A7GRM1SMN1; SMN2
SCHEMBL6904992 0.72 MAPK1 (0.55) SLC6A7LMNASMN1; SMN2

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