SCHEMBL1561591

SCHEMBL1561591

C=CC(=O)OCCCCCCCCCCCCCCCCCCN

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.79
ALDH1A1 P00352 5/20 0.79
CYP3A4 P08684 2/20 0.79
HPGD P15428 1/20 0.59
TP53 P04637 3/20 0.54
HIF1A Q16665 3/20 0.54
HSD17B10 Q99714 1/20 0.54
THRB P10828 3/20 0.41
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HCAR2 Q8TDS4 2/20 0.39
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.37
PLG P00747 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
SLC6A2 P23975 1/20 0.37
RECQL P46063 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1562683 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9585943 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9586578 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL22609061 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL22609059 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL6689529 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL1562751 1.00 TSHR (0.79) TSHRALDH1A1CYP3A4HPGDTP53
Hydrochloric Acid SCHEMBL21496309 0.98 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDTP53
Hydrochloric Acid SCHEMBL28829821 0.98 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL111189 0.98 TSHR (0.75) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080004402-A1 Polymeric product for film formation BORBELY JANOS 2008-01-03 US claimed
EP-1201720-B1 Printing fluid additives promoting overcoat adhesion HEWLETT PACKARD CO (US) 2004-09-15 EP claimed
US-6610412-B2 Clear protective thermal transfer overcoating and acrylic polymer compatibilizer; computer prints HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2003-08-26 US claimed
US-20030119973-A1 Printing fluid additives promoting overcoat adhesion HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2003-06-26 US claimed
US-6417249-B1 INK JET PRINTING INK FOR COLOR VEHICLES, CORE/SHELL BINDERS, SMUDGE PROOF HEWLETT-PACKARD COMPANY 2002-07-09 US claimed
EP-1201720-A1 Printing fluid additives promoting overcoat adhesion Hewlett-Packard Company (US) 2002-05-02 EP claimed
US-6248805-B1 THERMAL INK JET PRNTING HEWLETT-PACKARD COMPANY 2001-06-19 US claimed
US-6057384-A VEHICLE AND COLORANT ASSOCIATED WITH A PRIMER CORE/SHELL POLYMER; DURABLR SMEAR-FAST FILM HEWLETT-PACKARD COMPANY (US) 2000-05-02 US claimed
US-5990202-A DURABLE, SMEAR-FAST INK FILMS COMPRISING DUAL ENCAPSULATED COLORANT; A PRIMER CORE/SHELL POLYMER COATING A COLORANT (ADHESION) AND AN EXTERIOR CORE/SHELL POLYMER COATING FOR DURABILITY HEWLETT-PACKARD COMPANY (US) 1999-11-23 US claimed
EP-1027392-B1 LATEX POLYMER BLENDS FOR INK-JET INKS HEWLETT PACKARD CO (US) 2011-04-06 EP disclosed
US-7772343-B2 core/shell vinyl polymers; powder coating; reacting butyl acrylate with ethylene glycol di(meth)acrylate through free radical polymerization in a solvent; post crosslinking in toluene to form hydrophobic core; further reaction with hydroxyethyl (meth)acrylate; coatings, binders BORBELY JANOS 2010-08-10 US disclosed
EP-1027391-B1 INK-JET INK COMPOSITIONS HAVING MAGNETIC PROPERTIES HEWLETT PACKARD CO (US) 2010-03-03 EP disclosed
EP-1949484-A2 ELECTROLYTE MEMBRANE FOR FUEL CELL UTILIZING NANO COMPOSITE The Board of Management of Saigon Hi-Tech Park (VN) 2008-07-30 EP disclosed
US-20080004402-A1 Polymeric product for film formation BORBELY JANOS 2008-01-03 US disclosed
US-6057384-A VEHICLE AND COLORANT ASSOCIATED WITH A PRIMER CORE/SHELL POLYMER; DURABLR SMEAR-FAST FILM HEWLETT-PACKARD COMPANY (US) 2000-05-02 US disclosed
US-5990202-A DURABLE, SMEAR-FAST INK FILMS COMPRISING DUAL ENCAPSULATED COLORANT; A PRIMER CORE/SHELL POLYMER COATING A COLORANT (ADHESION) AND AN EXTERIOR CORE/SHELL POLYMER COATING FOR DURABILITY HEWLETT-PACKARD COMPANY (US) 1999-11-23 US disclosed
WO-1999023182-A1 LATEX POLYMER BLENDS FOR INK-JET INKS HEWLETT-PACKARD COMPANY (US) 1999-05-14 WO disclosed
WO-1999023181-A1 INK-JET INK COMPOSITIONS HAVING MAGNETIC PROPERTIES HEWLETT-PACKARD COMPANY (US) 1999-05-14 WO disclosed
WO-1999023183-A1 PRINTING INK COMPOSITIONS HAVING SUPERIOR SMEAR-FASTNESS HEWLETT-PACKARD COMPANY (US) 1999-05-14 WO disclosed
WO-1999023126-A1 DURABLE, FILM-FORMING, WATER-DISPERSIVE POLYMERS HEWLETT-PACKARD COMPANY (US) 1999-05-14 WO disclosed