SCHEMBL3667595

SCHEMBL3667595

CCCC[CH]CCOc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.61
KCNA3 P22001 1/20 0.54
DRD2 P14416 2/20 0.50
DRD3 P35462 2/20 0.50
MLNR O43193 1/20 0.50
NR1I2 O75469 1/20 0.50
ESR1 P03372 1/20 0.50
NR3C1 P04150 1/20 0.50
PGR P06401 1/20 0.50
ADRB2 P07550 1/20 0.50
CHRM2 P08172 1/20 0.50
ADRB1 P08588 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
CHRM1 P11229 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
CHRM3 P20309 1/20 0.50
MAOA P21397 1/20 0.50

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
SCHEMBL10423351 0.95 LTA4H (0.61) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL302001 0.93 LTA4H (0.59) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL3529054 0.83 KCNA3 (0.56) LTA4HKCNA3DRD2DRD3ALDH1A1
SCHEMBL8199906 0.83 LTA4H (0.53) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL1331014 0.82 LTA4H (0.87) LTA4HKCNA3DRD2DRD3MLNR
Benzene SCHEMBL28132981 0.82 LTA4H (0.87) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL36192 0.82 LTA4H (0.87) LTA4HKCNA3DRD2DRD3MLNR
Phosphine SCHEMBL28317749 0.80 LTA4H (0.83) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL28109019 0.80 LTA4H (0.83) LTA4HKCNA3DRD2DRD3MLNR
SCHEMBL22319104 0.80 LTA4H (0.83) LTA4HKCNA3DRD2DRD3MLNR

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-2238145-A1 HYDROSILYLATION REACTIONS ACTIVATED THROUGH RADIATION Wacker Chemie AG (DE) 2010-10-13 EP disclosed
WO-2009092762-A1 HYDROSILYLATION REACTIONS ACTIVATED THROUGH RADIATION WACKER CHEMIE AG (DE) 2009-07-30 WO disclosed