Bisphenol A

Bisphenol A

SCHEMBL6284690

CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.O=C(O)c1ccccc1C(=O)O

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.70
ESR1 P03372 5/20 0.70
ESR2 Q92731 5/20 0.70
CYP3A4 P08684 4/20 0.70
HPGD P15428 2/20 0.61
AR P10275 1/20 0.61
TSHR P16473 1/20 0.61
SLC6A2 P23975 1/20 0.61
SLC6A4 P31645 1/20 0.61
HTR6 P50406 1/20 0.61
ESRRG P62508 1/20 0.61
SLC6A3 Q01959 1/20 0.61
HSD17B10 Q99714 1/20 0.61
ALOX15 P16050 2/20 0.54
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47

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
Bisphenol A SCHEMBL29376592 1.00 ALDH1A1 (0.70) ALDH1A1ESR1ESR2CYP3A4HPGD
Bisphenol A SCHEMBL30693768 0.93 ESR1 (0.61) ALDH1A1ESR1ESR2CYP3A4HPGD
Bisphenol A SCHEMBL29483751 0.91 ALDH1A1 (0.63) ALDH1A1ESR1ESR2CYP3A4HPGD
Bisphenol A SCHEMBL29365664 0.91 ALDH1A1 (0.63) ALDH1A1ESR1ESR2CYP3A4HPGD
SCHEMBL6284689 0.86 ESR1 (0.53) ALDH1A1ESR1ESR2CYP3A4HPGD
Bicarbonate SCHEMBL23683863 0.86 ESR1 (0.87) ALDH1A1ESR1ESR2CYP3A4HPGD
Bicarbonate SCHEMBL21681661 0.86 ESR1 (0.87) ALDH1A1ESR1ESR2CYP3A4HPGD
Bisphenol A SCHEMBL4809570 0.86 ESR1 (0.79) ALDH1A1ESR1ESR2CYP3A4HPGD
Bicarbonate SCHEMBL1031673 0.86 ESR1 (0.87) ALDH1A1ESR1ESR2CYP3A4HPGD
Bisphenol A SCHEMBL5935233 0.85 ESR1 (0.70) ALDH1A1ESR1ESR2CYP3A4HPGD

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-6921618-B2 Photoconductive organic pigment, photoconductive organic pigment dispersion liquid, electrophotographic photoreceptor and electrophotographic device using the same FUJI XEROX CO., LTD. (JP) 2005-07-26 US disclosed
US-20040063013-A1 Photoconductive organic pigment, photoconductive organic pigment dispersion liquid, electrophotographic photoreceptor and electrophotographic device using the same FUJI XEROX CO., LTD. (JP) 2004-04-01 US disclosed
US-4501808-A CARBONIUM OR SULFONIUM COMPOUND; OPTICAL RECORDING MEDIA CANON KABUSHIKI KAISHA (JP) 1985-02-26 US disclosed
US-4495264-A ORGANIC PIGMENTS; STABLE CHARGE-CARRYING PROPERTY; DURABILITY CANON KABUSHIKI KAISHA (JP) 1985-01-22 US disclosed