SCHEMBL13098201

SCHEMBL13098201

CCCCOc1ccc(C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.63
GPR88 Q9GZN0 2/20 0.52
FAAH O00519 1/20 0.51
SLC2A1 P11166 2/20 0.50
KCNA3 P22001 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MLNR O43193 1/20 0.47
NR1I2 O75469 1/20 0.47
ESR1 P03372 1/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
ADRB2 P07550 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47

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
SCHEMBL5814534 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL382172 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL5820215 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL4798970 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL4801993 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL382629 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL5819935 0.95 LTA4H (0.64) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL2494575 0.92 SLC2A1 (0.56) LTA4HSLC2A1CYP1A2CYP2D6CYP19A1
SCHEMBL5819934 0.89 LTA4H (0.57) LTA4HGPR88FAAHSLC2A1MLNR
SCHEMBL5820374 0.89 LTA4H (0.57) LTA4HGPR88FAAHSLC2A1MLNR

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-20100255420-A1 RADIATION SENSITIVE RESIN COMPOSITION AND POLYMER JSR CORPORATION (JP) 2010-10-07 US disclosed