SCHEMBL11295043

SCHEMBL11295043

Oc1cnc2ccccc2c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.55
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
KDM4E B2RXH2 4/20 0.47
GPR3 P46089 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
HDAC6 Q9UBN7 1/20 0.37
IDO1 P14902 1/20 0.37
NCF1 P14598 1/20 0.36
NOS1 P29475 1/20 0.36
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36

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
SCHEMBL30583086 0.78 MAOA (0.54) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL2927980 0.78 ERN1 (0.58) ERN1KDM4EGPR3ALDH1A1HPGD
SCHEMBL28220033 0.78 MAOA (0.54) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL844114 0.76 MAOA (0.47) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL29951070 0.76 ERN1 (0.51) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL29954370 0.76 MAOA (0.47) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL601463 0.75 MAOA (0.50) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL5745844 0.75 MAOA (0.50) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL6822558 0.75 MAOA (0.50) ERN1MAOAMAOBKDM4EGPR3
SCHEMBL5706967 0.75 KDM4E (0.47) ERN1MAOAMAOBKDM4EGPR3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0011460-B1 PEROXYGEN BLEACHING AND COMPOSITIONS THEREFOR FMC Corporation (US) 1982-09-29 EP disclosed
US-4215003-A INCLUDING HETEROCYCLIC SULFONATE ESTERS OF AN ALKANE- OR ARYLSULFONIC ACID AS ACTIVATORS; LOW TEMPERATURE FMC CORPORATION (US) 1980-07-29 US disclosed
EP-0011460-A1 Peroxygen bleaching and compositions therefor FMC Corporation (US) 1980-05-28 EP disclosed