SCHEMBL4474773

SCHEMBL4474773

CCCc1cc(O)ccc1C(C)(C)c1cccc(C(C)(C)c2ccc(O)cc2CCC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.50
ESR2 Q92731 7/20 0.50
CYP3A4 P08684 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TYR P14679 3/20 0.37
HSD17B3 P37058 1/20 0.36
ALOX15 P16050 2/20 0.35
TSHR P16473 2/20 0.35
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
ALOX5 P09917 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PTPN1 P18031 1/20 0.34
PTPN11 Q06124 1/20 0.34
HSD17B10 Q99714 2/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 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
SCHEMBL4457051 0.91 TYR (0.49) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4469282 0.90 ALOX5 (0.49) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4472437 0.88 ALOX5 (0.51) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4469294 0.88 ALOX5 (0.51) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4465516 0.87 ESR1 (0.53) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL11213586 0.87 TYR (0.43) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4470339 0.84 ESR1 (0.46) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL4457785 0.81 ESR1 (0.50) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL15131858 0.80 TYR (0.48) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL8582208 0.77 TYR (0.58) ESR1ESR2CYP3A4ALDH1A1TYR

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