SCHEMBL6512656

SCHEMBL6512656

CNC1OCN(c2ccc(F)c(Cl)c2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
KAT2B Q92831 2/20 0.42
PIN1 Q13526 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
POLB P06746 2/20 0.40
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
RAD51 Q06609 1/20 0.38
KCNH2 Q12809 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
BRD9 Q9H8M2 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL6508357 0.85 IDO1 (0.31)
SCHEMBL6527741 0.81 NOTUM (0.45) CYP1A2CYP2D6CYP2C19KMT2AMEN1
SCHEMBL7819041 0.80 CYP1A2 (0.44) CYP1A2CYP2D6CYP2C19KAT2BPIN1
SCHEMBL6530315 0.75 CYP2D6 (0.50) CYP1A2CYP2D6CYP2C19KMT2AMEN1
SCHEMBL6510492 0.75 KAT2B (0.46) CYP1A2CYP2D6CYP2C19KAT2BPIN1
SCHEMBL6508760 0.73 CA12 (0.45) CYP1A2KMT2AMEN1GAADRD2
SCHEMBL6508236 0.71 ROCK2 (0.38) KMT2AALDH1A1
SCHEMBL13116279 0.68 CYP2D6 (0.52) CYP1A2CYP2D6CYP2C19KMT2AMEN1
SCHEMBL8554615 0.67 SLC6A2 (0.47) CYP1A2CYP2D6CYP2C19KAT2BPIN1
SCHEMBL8554739 0.67 DRD2 (0.45) CYP1A2CYP2D6CYP2C19KAT2BPIN1

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-2005000824-A1 LAZOLIDINE DERIVATIVES AS HERBICIDAL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-01-06 WO disclosed