SCHEMBL20156964

SCHEMBL20156964

Cc1cc(C)c(C(=O)N2CCN(c3ccc(F)cn3)CC2)cc1CN1CCN(c2ccccc2C#N)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTOR P42345 7/20 0.49
RPTOR Q8N122 7/20 0.49
MLST8 Q9BVC4 7/20 0.49
PPARG P37231 1/20 0.44
PARP1 P09874 1/20 0.42
PRKAA2 P54646 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC27A1 Q6PCB7 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RET P07949 3/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 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
SCHEMBL20141707 0.97 MTOR (0.47) MTORRPTORMLST8PPARGPARP1
SCHEMBL20139989 0.90 MTOR (0.49) MTORRPTORMLST8PARP1L3MBTL1
SCHEMBL20140388 0.89 MTOR (0.47) MTORRPTORMLST8PPARGPARP1
SCHEMBL20156997 0.89 MTOR (0.44) MTORRPTORMLST8PPARGPARP1
SCHEMBL20139972 0.89 MTOR (0.48) MTORRPTORMLST8PARP1L3MBTL1
SCHEMBL20139934 0.89 PPARG (0.47) MTORRPTORMLST8PPARGPARP1
SCHEMBL20140246 0.88 MTOR (0.57) MTORRPTORMLST8PARP1L3MBTL1
SCHEMBL20140719 0.88 MTOR (0.57) MTORRPTORMLST8PARP1L3MBTL1
SCHEMBL20139878 0.88 PRKAA2 (0.43) MTORRPTORMLST8PPARGPRKAA2
SCHEMBL20140200 0.88 MTOR (0.59) MTORRPTORMLST8PARP1KDM4E

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