Bisphenol A

Bisphenol A

SCHEMBL9418253

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

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.47
ESR2 Q92731 5/20 0.47
CYP3A4 P08684 3/20 0.47
AR P10275 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
SLC6A2 P23975 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
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 7/20 0.40
LMNA P02545 3/20 0.40
POLB P06746 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36

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 SCHEMBL9149445 0.99 ESR1 (0.46) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL30620172 0.86 ESR1 (0.55) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL9147592 0.86 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL22319407 0.86 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL9185720 0.86 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL347900 0.86 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL4219076 0.86 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL9233341 0.85 ESR1 (0.43) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL28886001 0.82 ESR1 (0.47) ESR1ESR2CYP3A4ARHPGD
Methacrylic Acid SCHEMBL8843428 0.81 ALDH1A1 (0.71) ESR1ESR2CYP3A4ARHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310919-B1 Adhesive composition for biomaterial use DAIKIN IND LTD (JP) 1994-01-05 EP disclosed
US-5061184-A Fluorine-containing acrylic esters; dentistry DAIKIN INDUSTRIES, LTD. (JP) 1991-10-29 US disclosed
EP-0310919-A2 Adhesive composition for biomaterial use DAIKIN INDUSTRIES, LIMITED (JP) 1989-04-12 EP disclosed