SCHEMBL822914

SCHEMBL822914

Cc1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(O)cc3)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.80
ESR2 Q92731 10/20 0.80
CYP3A4 P08684 3/20 0.80
HPGD P15428 3/20 0.80
HSD17B10 Q99714 3/20 0.80
TSHR P16473 2/20 0.80
AR P10275 1/20 0.80
SLC6A2 P23975 1/20 0.80
SLC6A4 P31645 1/20 0.80
HTR6 P50406 1/20 0.80
ESRRG P62508 1/20 0.80
SLC6A3 Q01959 1/20 0.80
ALDH1A1 P00352 3/20 0.67
ACHE P22303 2/20 0.65
LMNA P02545 2/20 0.56
TYR P14679 2/20 0.56
SHBG P04278 1/20 0.46
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL1101874 1.00 ESR1 (0.80) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL19901313 0.93 ESR1 (0.70) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL22782579 0.93 ESR1 (0.70) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL14922956 0.93 ESR1 (0.70) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL12299307 0.93 ESR1 (0.70) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL2385710 0.93 ESR1 (0.70) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL27996 0.89 ESR1 (1.00) ESR1ESR2CYP3A4HPGDHSD17B10
Bisphenol A SCHEMBL9774987 0.89 ESR1 (1.00) ESR1ESR2CYP3A4HPGDHSD17B10
Bisphenol A SCHEMBL3170263 0.89 ESR1 (1.00) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL15868669 0.89 ESR1 (1.00) ESR1ESR2CYP3A4HPGDHSD17B10

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043448-B2 Compositions for containers and other articles and methods of using same SWIMC LLC (US) 2024-07-23 US disclosed
US-20230365302-A1 COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF USING SAME SWIMC LLC (US) 2023-11-16 US disclosed
EP-3483227-B1 COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF USING SAME SWIMC LLC (US) 2020-12-16 EP disclosed
US-20180216008-A1 HEPTAPHOSPHORUS-DERIVED COMPOUNDS AS FLAME RETARDANTS BASF SE (DE) 2018-08-02 US disclosed
US-20170369679-A1 NOR-HALS COMPOUNDS AS FLAME RETARDANTS BASF SE (DE) 2017-12-28 US disclosed
US-9783655-B2 NOR-HALS compounds as flame retardants BASF SE (DE) 2017-10-10 US disclosed
US-20160229989-A1 NOR-HALS COMPOUNDS AS FLAME RETARDANTS BASF SE (DE) 2016-08-11 US disclosed
US-20150284535-A1 NOR-HALS COMPOUNDS AS FLAME RETARDANTS BASF SE (DE) 2015-10-08 US disclosed
US-20150148464-A1 FLAME RETARDANT COMPOSITIONS OF PHOSPHINIC ACID SALTS AND NITROXYL DERIVATIVES BASF SE (DE) 2015-05-28 US disclosed
US-8877838-B2 Melamine phenylphosphinate flame retardant compositions BASF SE (DE) 2014-11-04 US disclosed
US-20130059952-A1 PHOSPHO-SUBSTITUTED ALKOXYAMINE COMPOUNDS BASF SE (DE) 2013-03-07 US disclosed
US-8349224-B2 Melamine phenylphosphonate flame retardant compositions BASF SE Ludwigshafen (DE) 2013-01-08 US disclosed
US-8236881-B2 DOPO flame retardant compositions BASF SE (DE) 2012-08-07 US disclosed
US-20120108712-A1 PHENYLPHOSPHONATE FLAME RETARDANT COMPOSITIONS BASF SE (DE) 2012-05-03 US disclosed
US-20120095140-A1 DOPO FLAME RETARDANT COMPOSITIONS ROTH MICHAEL (DE) 2012-04-19 US disclosed
US-20110294920-A1 DOPO-FLAME RETARDANT IN EPOXY RESINS BASF SE (DE) 2011-12-01 US disclosed
US-20110288206-A1 MELAMINE PHENYLPHOSPHINATE FLAME RETARDANT COMPOSITIONS BASF SE (DE) 2011-11-24 US disclosed
US-20110266507-A1 MELAMINE PHENYLPHOSPHONATE FLAME RETARDANT COMPOSITIONS BASF SE (DE) 2011-11-03 US disclosed
US-20110237715-A1 FLAME RETARDANT COMPOSITIONS OF PHOSPHINIC ACID SALTS AND NITROXYL DERIVATIVES BASF SE (DE) 2011-09-29 US disclosed
US-20110190428-A1 FLAME RETARDANT COMPOSITIONS WITH POLYMERIC DISPERSING AGENTS BASF SE (DE) 2011-08-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110288206-A1 MELAMINE PHENYLPHOSPHINATE FLAME RETARDANT COMPOSITIONS PHOSPHO1, FLAD1, PFAS ESR1 1985/4885ESR2 871/4885CYP3A4 2218/4885
US-20180216008-A1 HEPTAPHOSPHORUS-DERIVED COMPOUNDS AS FLAME RETARDANTS PFAS, PCBP1, DDT ESR1 2299/4885ESR2 2354/4885CYP3A4 1146/4885
US-20170369679-A1 NOR-HALS COMPOUNDS AS FLAME RETARDANTS PFAS, NONO, PARG ESR1 4170/4885ESR2 3543/4885CYP3A4 2209/4885
US-20130059952-A1 PHOSPHO-SUBSTITUTED ALKOXYAMINE COMPOUNDS PFAS, PHOSPHO1, PIK3CA ESR1 3454/4885ESR2 3778/4885CYP3A4 2362/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.