SCHEMBL9316397

SCHEMBL9316397

OC(O)CNCc1ccc(Cl)nc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
OXTR P30559 1/20 0.51
AVPR1A P37288 1/20 0.51
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2C9 P11712 1/20 0.39
NAMPT P43490 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL9279836 0.83 GAA (0.63) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL27977498 0.83 KDM4E (0.51) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL229169 0.83 GAA (0.51) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL502303 0.81 GAA (0.50) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL15926086 0.80 KDM4E (0.49) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL7999050 0.80 KDM4E (0.49) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL6317403 0.80 KDM4E (0.49) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL16585876 0.79 KDM4E (0.47) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL7992401 0.78 KDM4E (0.46) GAAKDM4EMAPTL3MBTL1OXTR
SCHEMBL29777000 0.77 KDM4E (0.53) GAAKDM4EMAPTL3MBTL1OXTR

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
US-5298507-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1994-03-29 US disclosed