SCHEMBL8108512

SCHEMBL8108512

CC(C)Oc1cc(O)ccc1C(C)(C)c1cccc(C(C)(C)c2ccc(O)cc2OC(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.49
ESR2 Q92731 4/20 0.49
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
CYP3A4 P08684 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RXFP1 Q9HBX9 1/20 0.34
HSD17B10 Q99714 2/20 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
TYR P14679 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
NFE2L2 Q16236 1/20 0.33
MAOB P27338 1/20 0.33
AR P10275 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 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
SCHEMBL9423891 0.87 HSD17B10 (0.38) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL8113342 0.83 ESR1 (0.53) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL4471833 0.79 ESR1 (0.49) ESR1ESR2CYP3A4ALDH1A1RXFP1
SCHEMBL4460177 0.78 ESR1 (0.55) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL4465968 0.77 ESR1 (0.46) ESR1ESR2CYP3A4ALDH1A1HTT
SCHEMBL4463750 0.75 ESR1 (0.45) ESR1ESR2ALDH1A1CYP2C9
SCHEMBL1448894 0.75 ESR1 (0.60) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL29599541 0.75 ESR1 (0.60) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL4457785 0.74 ESR1 (0.50) ESR1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL4457796 0.74 ESR1 (0.58) ESR1ESR2HSD17B1HSD17B2CYP3A4

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-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