SCHEMBL656808

SCHEMBL656808

C#CCCC(CCC(=O)O)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.53
ESR2 Q92731 5/20 0.53
CYP3A4 P08684 2/20 0.53
ALDH1A1 P00352 1/20 0.53
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPT P10636 1/20 0.37
CYP2C19 P33261 1/20 0.37
CHEK1 O14757 1/20 0.36
FYN P06241 1/20 0.36
PDGFRB P09619 1/20 0.36
PIM1 P11309 1/20 0.36
FGFR1 P11362 1/20 0.36
FLT1 P17948 1/20 0.36
GRK5 P34947 1/20 0.36
MAP2K2 P36507 1/20 0.36
MAPK8 P45983 1/20 0.36
CDK8 P49336 1/20 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
SCHEMBL3131841 0.79 ESR1 (0.72) ESR1ESR2CYP3A4ALDH1A1CHEK1
SCHEMBL3693611 0.77 ESR1 (0.64) ESR1ESR2CYP3A4ALDH1A1CYP1A2
SCHEMBL656272 0.76 ESR1 (0.74) ESR1ESR2CYP3A4ALDH1A1CHEK1
SCHEMBL660462 0.75 ESR1 (0.53) ESR1ESR2CYP3A4ALDH1A1CYP2C9
SCHEMBL3470640 0.74 ESR1 (0.65) ESR1ESR2CYP3A4ALDH1A1HSD17B10
SCHEMBL3471552 0.74 ESR1 (0.65) ESR1ESR2CYP3A4ALDH1A1HSD17B10
SCHEMBL3471623 0.74 ESR1 (0.65) ESR1ESR2CYP3A4ALDH1A1HSD17B10
SCHEMBL3120824 0.73 ESR1 (0.58) ESR1ESR2CYP3A4ALDH1A1CYP2C9
SCHEMBL7465712 0.71 ALDH1A1 (0.39) ESR1ESR2CYP3A4ALDH1A1CYP1A2
SCHEMBL20810621 0.70 ESR1 (0.59) ESR1ESR2CYP3A4ALDH1A1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4520379-A CHROMOGEN, ACIDIC DEVELOPER AND BINDER ON SUPPORT APPLETON PAPERS INC. (US) 1985-05-28 US claimed
EP-4022391-B1 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS SOLENIS TECHNOLOGIES CAYMAN LP (KY) 2026-03-04 EP disclosed
US-12151497-B2 Heat sensitive recording material with non-phenolic color developers SOLENIS TECHNOLOGIES, L.P. (US) 2024-11-26 US disclosed
EP-4022391-A2 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS Solenis Technologies Cayman, L.P. (KY) 2022-07-06 EP disclosed
US-20210060994-A1 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS BASF SE (DE) 2021-03-04 US disclosed
WO-2021041600-A2 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS SOLENIS TECHNOLOGIES CAYMAN, L.P. (KY) 2021-03-04 WO disclosed
US-9982157-B2 Aqueous laser-sensitive composition for marking substrates DATALASE LTD. (GB) 2018-05-29 US disclosed
US-20150361289-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES DATALASE LTD. (GB) 2015-12-17 US disclosed
US-20140342293-A1 HEAT SENSITIVE COATING COMPOSITION BASF SE (DE) 2014-11-20 US disclosed
US-20120045624-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES BASF SE (DE) 2012-02-23 US disclosed
EP-2349734-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES DataLase Ltd (GB) 2011-08-03 EP disclosed
WO-2010049281-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES BASF SE (DE) 2010-05-06 WO disclosed
US-7517397-B2 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. (US) 2009-04-14 US disclosed
US-20060240981-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2006-10-26 US disclosed
US-20050221982-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-10-06 US disclosed
US-6635602-B1 Heat sensitive and pressure sensitive recording material; synthesised directly by the reaction of two derivatives of amino phenols, phthalic anhydrides, keto acids and/or diphenylamines with a phenol derivative CIBA SPECIALTY CHEMICALS CORPORATION 2003-10-21 US disclosed
US-6624117-B1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORPORATION 2003-09-23 US disclosed
US-6566302-B1 For use in heat sensitive and pressure sensitive recording materials CIBA SPECIALTY CHEMICALS CORPORATION 2003-05-20 US disclosed
EP-0928794-A1 Crystalline flouran compounds and their use in recording materials Ciba SC Holding AG (CH) 1999-07-14 EP disclosed
US-4520379-A CHROMOGEN, ACIDIC DEVELOPER AND BINDER ON SUPPORT APPLETON PAPERS INC. (US) 1985-05-28 US disclosed