SCHEMBL3963330

SCHEMBL3963330

CC(CC(c1ccccc1)(c1ccc(O)cc1)c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 12/20 0.59
ESR1 P03372 11/20 0.59
CYP3A4 P08684 4/20 0.59
ALDH1A1 P00352 2/20 0.59
SHBG P04278 1/20 0.47
KIF11 P52732 1/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
LMNA P02545 1/20 0.45
TYR P14679 1/20 0.45
AR P10275 1/20 0.45
TSHR P16473 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
HTR6 P50406 1/20 0.45
ESRRG P62508 1/20 0.45
SLC6A3 Q01959 1/20 0.45
CACNA1B Q00975 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL11352348 0.85 SHBG (0.62) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL27172081 0.85 SHBG (0.62) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL3967698 0.81 SHBG (0.60) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL23905030 0.80 ESR1 (0.63) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL2014300 0.80 ESR2 (0.63) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL14645683 0.78 ESR2 (0.61) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL27569103 0.78 ESR2 (0.61) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL7411903 0.78 CACNA1B (0.60) ESR2ESR1CYP3A4ALDH1A1KIF11
SCHEMBL69485 0.78 ESR1 (0.59) ESR2ESR1CYP3A4ALDH1A1SHBG
SCHEMBL6814948 0.78 ESR1 (0.59) ESR2ESR1CYP3A4ALDH1A1SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572611-B1 PROCESS FOR THE SYNTHESIS OF BISPHENOL SABIC INNOVATIVE PLASTICS IP (NL) 2009-07-22 EP disclosed
US-7132575-B2 Process for the synthesis of bisphenol GENERAL ELECTRIC COMPANY (US) 2006-11-07 US disclosed
US-7112702-B2 Process for the synthesis of bisphenol GENERAL ELECTRIC COMPANY (US) 2006-09-26 US disclosed
EP-1572611-A1 PROCESS FOR THE SYNTHESIS OF BISPHENOL GENERAL ELECTRIC COMPANY (US) 2005-09-14 EP disclosed
WO-2005005358-A1 PROCESS FOR THE SYNTHESIS OF BISPHENOL GENERAL ELECTRIC COMPANY (US) 2005-01-20 WO disclosed
US-20050004406-A1 Process for the synthesis of bisphenol SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2005-01-06 US disclosed
WO-2004054949-A1 PROCESS FOR THE SYNTHESIS OF BISPHENOL GENERAL ELECTRIC COMPANY (US) 2004-07-01 WO disclosed
US-20040116751-A1 PROCESS FOR THE SYNTHESIS OF BISPHENOL SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2004-06-17 US disclosed
US-6133190-A SUPPORTED MERCAPTOAKYL-SUBSTITUTED POLYSTYRENESULFONATE IS USED AS A CATALYST FOR CONDENSATION OF ALDEHYDE OR KETONE WITH PHENOL TO FORM DIHYDROXY COMPOUND THE DOW CHEMICAL COMPANY (US) 2000-10-17 US disclosed
US-6051658-A A POLYSTYRENE HAVING MERCAPTOSULFONIC ACID RESIDUE, USEFUL AS CATALYST THE DOW CHEMICAL COMPANY (US) 2000-04-18 US disclosed
US-5939494-A CATALYST USEFUL FOR THE CONDENSATION OF AN ALDEHYDE OR KETONE STARTING MATERIAL WITH A PHENOL IS AN INSOLUBLE MERCAPTOSULFONIC ACID COMPOUND THE DOW CHEMICAL COMPANY (US) 1999-08-17 US disclosed
EP-0848693-A4 ISOMERIZATION OF BISPHENOLS DOW CHEMICAL CO (US) 1999-03-17 EP disclosed
CN-1200105-A Isomerization of bisphenols DOW CHEMICAL CO (US) 1998-11-25 CN disclosed
EP-0848693-A1 ISOMERIZATION OF BISPHENOLS THE DOW CHEMICAL COMPANY (US) 1998-06-24 EP disclosed
WO-1997008122-A1 ISOMERIZATION OF BISPHENOLS THE DOW CHEMICAL COMPANY (US) 1997-03-06 WO disclosed
EP-0725771-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-08-14 EP disclosed
WO-1996006819-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-03-07 WO disclosed
US-5463140-A Condensing aldehyde or ketone with phenol in presence of soluble or insoluble mercaptosulfonic acid compound to form geminal bisphenol moiety at each aldehyde or ketone moiety THE DOW CHEMICAL COMPANY (US) 1995-10-31 US disclosed