SCHEMBL20156792

SCHEMBL20156792

CCc1nccc2cn[nH]c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
NOS1 P29475 3/20 0.39
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
PLK4 O00444 1/20 0.34
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
MAP4K4 O95819 1/20 0.34
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
FGFR1 P11362 1/20 0.34
PDGFRA P16234 1/20 0.34
LTK P29376 1/20 0.34
KDR P35968 1/20 0.34
MAP2K2 P36507 1/20 0.34
FLT3 P36888 1/20 0.34
CSNK1A1 P48729 1/20 0.34
PRKX P51817 1/20 0.34
CDK5 Q00535 1/20 0.34

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
SCHEMBL30911413 0.81 NOS1 (0.39) MAPTNOS1PDE3BPDE3APLK4
SCHEMBL19153804 0.76 ALDH1A1 (0.44) PDE3BPDE3AKDM4EHPGDSMN1; SMN2
SCHEMBL12480129 0.75 MAPT (0.48) MAPTNOS1PLK4CHEK1AURKA
SCHEMBL18237557 0.74 PDE3B (0.44) PDE3BPDE3ABTKKDM4EHPGD
SCHEMBL18237595 0.72 MAPT (0.42) MAPTNOS1PLK4CHEK1AURKA
SCHEMBL13178567 0.72 REN (0.43) PDE3BPDE3AGRM4
SCHEMBL402053 0.71 MAPT (0.48) MAPTNOS1PLK4CHEK1AURKA
SCHEMBL1154955 0.71 NOS1 (0.42) MAPTNOS1PLK4CHEK1AURKA
SCHEMBL2366705 0.71 NOS1 (0.52) MAPTNOS1PDE3BPDE3APLK4
SCHEMBL12480398 0.71 NOS1 (0.52) MAPTNOS1PLK4CHEK1AURKA

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