SCHEMBL5995899

SCHEMBL5995899

CCC(C)(c1cc(C)c(O)c(C)c1)c1cc(C)c(O)c(C)c1.CCC(C)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.52
ESR2 Q92731 12/20 0.52
AR P10275 2/20 0.44
CYP3A4 P08684 2/20 0.43
LMNA P02545 1/20 0.43
TYR P14679 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR6 P50406 1/20 0.43
ESRRG P62508 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SHBG P04278 1/20 0.41

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
SCHEMBL226013 0.88 ESR1 (0.64) ESR1ESR2ARTYRTSHR
SCHEMBL9504914 0.87 ESR1 (0.50) ESR1ESR2AR
SCHEMBL7101111 0.87 ESR1 (0.53) ESR1ESR2ARCYP3A4LMNA
SCHEMBL68287 0.86 ESR1 (0.62) ESR1ESR2ARCYP3A4LMNA
Methyl Alcohol SCHEMBL28148921 0.84 ESR1 (0.60) ESR1ESR2ARCYP3A4LMNA
SCHEMBL10909749 0.84 ESR1 (0.69) ESR1ESR2AR
SCHEMBL14760222 0.84 ESR1 (0.69) ESR1ESR2AR
SCHEMBL8735289 0.84 ESR1 (0.61) ESR1ESR2AR
SCHEMBL12445107 0.83 ESR1 (0.41) ESR1ESR2ARCYP3A4LMNA
SCHEMBL822723 0.82 ACHE (0.54) ESR1ESR2ARCYP3A4LMNA

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-20060078693-A1 Method of manufacturing a birefringent film, optical film using the same, liquid crystal panel, liquid crystal display device and imaged display device NITTO DENKO CORPORATION (JP) 2006-04-13 US disclosed