SCHEMBL14071024

SCHEMBL14071024

Fc1ccc2c(c1)OC(C1CCC(CCCCC3CCCCC3)CC1)CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.38
FFAR1 O14842 1/20 0.36
CHRNA7 P36544 2/20 0.36
OPRL1 P41146 4/20 0.34
AKR1B1 P15121 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
GHSR Q92847 2/20 0.32
MLNR O43193 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.32
KCNE1 P15382 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
CNR1 P21554 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
SCHEMBL14070987 0.95 STS (0.39) STSFFAR1CHRNA7OPRL1AKR1B1
SCHEMBL14070963 0.86 STS (0.46) STSFFAR1CHRNA7AKR1B1GHSR
SCHEMBL14070908 0.86 STS (0.48) STSFFAR1CHRNA7AKR1B1GHSR
SCHEMBL4944926 0.85 HTR1D (0.38) STSFFAR1CHRNA7AKR1B1GHSR
SCHEMBL14071018 0.84 OPRL1 (0.34) OPRL1HTR1A
SCHEMBL14070995 0.82 STS (0.41) STSFFAR1CHRNA7OPRL1AKR1B1
SCHEMBL14070994 0.80 STS (0.39) STSFFAR1CHRNA7AKR1B1GHSR
SCHEMBL14070989 0.79 OPRL1 (0.36) OPRL1DRD2DRD3
SCHEMBL14070941 0.78 DRD2 (0.36) OPRL1GHSRMLNRADRB2ADRB1
SCHEMBL14071016 0.78 SIGMAR1 (0.33) STSTDP1

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