SCHEMBL5239681

SCHEMBL5239681

CN1CCN(c2c(F)cc(N)cc2F)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
BRD4 O60885 1/20 0.36
BRD2 P25440 1/20 0.36
DPP4 P27487 1/20 0.34
MAOA P21397 1/20 0.33
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
GFER P55789 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
BTK Q06187 1/20 0.31
TOP1 P11387 1/20 0.31
TOP2A P11388 1/20 0.31
KDM4E B2RXH2 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PIM1 P11309 1/20 0.30
ATR Q13535 1/20 0.30

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
SCHEMBL5213968 0.81 MAPT (0.55) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL5622837 0.80 ALDH1A1 (0.41) MAPTMAOAPDE3BPDE3AALDH1A1
SCHEMBL5244666 0.80 ALDH1A1 (0.47) MAPTALDH1A1LMNATOP1L3MBTL1
SCHEMBL17144408 0.78 MAPT (0.51) MAPTALDH1A1MAPK1GFERKDM4E
SCHEMBL5212713 0.75 MAOA (0.69) MAOALMNA
SCHEMBL216385 0.72 MAPT (0.59) MAPTBRD4BRD2ALDH1A1LMNA
SCHEMBL5243119 0.72 MAOA (0.57) MAOALMNA
SCHEMBL5246863 0.72 ALDH1A1 (0.38) MAPTDPP4MAOAPDE3BPDE3A
SCHEMBL5245062 0.71 KDM4E (0.36) DPP4ALDH1A1MAPK1KDM4EL3MBTL1
SCHEMBL17422290 0.71 CASP6 (0.54) MAPTALDH1A1LMNAGFERBTK

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-1819699-A2 DIAZEPINE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-08-22 EP disclosed
WO-2006056877-A2 DIAZEPINE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-06-01 WO disclosed