Bisphenol A

Bisphenol A

SCHEMBL9502167

CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.CCOC(=O)CCC(C)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.58
ESR2 Q92731 6/20 0.58
CYP3A4 P08684 3/20 0.58
ALDH1A1 P00352 3/20 0.58
TSHR P16473 2/20 0.47
SLC6A2 P23975 2/20 0.47
AR P10275 1/20 0.47
HPGD P15428 1/20 0.47
SLC6A4 P31645 1/20 0.47
HTR6 P50406 1/20 0.47
ESRRG P62508 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL3131837 0.95 ESR1 (0.63) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL312276 0.84 ESR1 (0.59) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL9157735 0.83 ESR1 (0.55) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL6748255 0.82 ESR1 (0.54) ESR1ESR2CYP3A4ALDH1A1CA12
SCHEMBL7130190 0.81 ESR1 (0.56) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL13386022 0.80 ESR1 (0.51) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL3125861 0.80 ESR1 (0.67) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL9702203 0.79 ESR1 (0.54) ESR1ESR2CYP3A4ALDH1A1AR
SCHEMBL1176814 0.79 ESR1 (0.54) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL3471549 0.79 ESR1 (0.54) ESR1ESR2CYP3A4ALDH1A1TSHR

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
EP-0319283-B1 THERMALLY RESPONSIVE RECORD MATERIAL APPLETON PAPERS INC. (US) 1993-06-09 EP claimed