SCHEMBL14070941

SCHEMBL14070941

Fc1ccc2c(c1)OC(CCC1CCCCC1)CC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.36
DRD3 P35462 3/20 0.36
DRD4 P21917 2/20 0.36
OPRL1 P41146 1/20 0.36
DRD1 P21728 1/20 0.36
DRD5 P21918 1/20 0.36
MLNR O43193 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
KCNE1 P15382 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CNR1 P21554 1/20 0.35
SLC6A2 P23975 1/20 0.35
NPY1R P25929 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL14070989 0.92 OPRL1 (0.36) DRD2DRD3DRD4OPRL1DRD1
SCHEMBL14071018 0.85 OPRL1 (0.34) OPRL1HTR1A
SCHEMBL14070987 0.83 STS (0.39) DRD2DRD3OPRL1MLNRADRB2
SCHEMBL14070951 0.80 FFAR4 (0.35) HTR1A
SCHEMBL14070949 0.78 CA2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL14071024 0.78 STS (0.38) DRD2DRD3OPRL1MLNRADRB2
SCHEMBL7391578 0.78 SLC6A2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1041687 0.78 DRD2 (0.45) DRD2DRD3DRD4DRD1DRD5
SCHEMBL14070942 0.75 FFAR4 (0.33)
SCHEMBL14071001 0.75 CA2 (0.38) SLC6A4

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
US-7429411-B2 Chroman compound, liquid crystal composition including the compound and liquid crystal display element including the liquid crystal composition CHISSO PETROCHEMICAL CORPORATION (JP) 2008-09-30 US disclosed
US-7429411-B2 Chroman compound, liquid crystal composition including the compound and liquid crystal display element including the liquid crystal composition CHISSO PETROCHEMICAL CORPORATION (JP) 2008-09-30 US disclosed