SCHEMBL20157205

SCHEMBL20157205

Cc1cc(C)c(C(=O)N2CCN(c3oc(C4CC4)nc3C)CC2)cc1CN1CCN(c2ccccc2C)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.54
RPTOR Q8N122 1/20 0.54
MLST8 Q9BVC4 1/20 0.54
MAPT P10636 3/20 0.41
HSD17B10 Q99714 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MYC P01106 1/20 0.41
DRD2 P14416 2/20 0.39
DRD4 P21917 2/20 0.39
TSHR P16473 3/20 0.39
USP2 O75604 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SLC6A5 Q9Y345 1/20 0.39
GRIN2B Q13224 1/20 0.39
LMNA P02545 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
SCHEMBL20157290 0.88 MTOR (0.50) MTORRPTORMLST8MAPTHSD17B10
SCHEMBL20157118 0.84 MTOR (0.76) MTORRPTORMLST8DRD2DRD4
SCHEMBL20157082 0.84 MYC (0.54) MAPTHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL20157206 0.80 MTOR (0.40) MTORRPTORMLST8MEN1KMT2A
SCHEMBL20157078 0.79 MYC (0.47) MAPTHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL20156914 0.78 MYC (0.46) MAPTHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL20157035 0.77 NPC1 (0.46) MTORRPTORMLST8MAPTSMN1; SMN2
SCHEMBL20157037 0.77 SLC6A7 (0.52) MEN1KMT2AMYC
SCHEMBL20157273 0.76 MEN1 (0.47) MAPTHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL20157353 0.76 MEN1 (0.47) MAPTHSD17B10SMN1; SMN2MEN1KMT2A

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
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed