SCHEMBL4457785

SCHEMBL4457785

CC(C)Cc1cc(O)ccc1C(C)(C)c1cccc(C(C)(C)c2ccc(O)cc2CC(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.50
ESR2 Q92731 4/20 0.50
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 2/20 0.37
RORC P51449 1/20 0.34
TYR P14679 3/20 0.33
HSD17B10 Q99714 2/20 0.33
SLC6A2 P23975 2/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
NR1I2 O75469 1/20 0.33
LMNA P02545 1/20 0.33
CYP2C9 P11712 1/20 0.33
MIF P14174 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KLF10 Q13118 1/20 0.33

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
SCHEMBL4470339 0.87 ESR1 (0.46) ESR1ESR2GABRA1GABRB2ALDH1A1
SCHEMBL4465516 0.84 ESR1 (0.53) ESR1ESR2GABRA1GABRB2ALDH1A1
SCHEMBL4474773 0.81 ESR1 (0.50) ESR1ESR2ALDH1A1CYP3A4TYR
SCHEMBL4457051 0.79 TYR (0.49) ESR1ESR2ALDH1A1CYP3A4TYR
SCHEMBL4460177 0.79 ESR1 (0.55) ESR1ESR2GABRA1GABRB2ALDH1A1
SCHEMBL4469282 0.78 ALOX5 (0.49) ESR1ESR2ALDH1A1CYP3A4TYR
SCHEMBL4472437 0.77 ALOX5 (0.51) ESR1ESR2ALDH1A1CYP3A4TYR
SCHEMBL4469294 0.77 ALOX5 (0.51) ESR1ESR2ALDH1A1CYP3A4TYR
SCHEMBL29599541 0.76 ESR1 (0.60) ESR1ESR2GABRA1GABRB2ALDH1A1
SCHEMBL1448894 0.76 ESR1 (0.60) ESR1ESR2GABRA1GABRB2ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582355-B2 Optical unit using plastic lenses FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed
US-20060046065-A1 Optical unit using plastic lenses FUJI PHOTO FILM CO., LTD. 2006-03-02 US disclosed
US-6028161-A EXCELLENT TRANSPARENCY, HEAT RESISTANCE AND MECHANICAL PROPERTIES AND A LOW BIREFRINGENCE, MELT FLUIDITY AND MOLDABILITY; AN OPTICAL DISK, LENS AND AN OPTICAL FIBER MITSUI CHEMICALS, INC. (JP) 2000-02-22 US disclosed
EP-0926180-A2 A polycarbonate copolymer and applications thereof Mitsui Chemicals, Inc. (JP) 1999-06-30 EP disclosed