SCHEMBL8425837

SCHEMBL8425837

C=C(C)C(=O)OCCCC.C=C(CC=C(C)C(=O)O)C(=O)OCCCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.55
THRB P10828 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 2/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.39
ATM Q13315 1/20 0.38
HCAR2 Q8TDS4 3/20 0.37
KDM4E B2RXH2 2/20 0.32
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NAAA Q02083 1/20 0.30
MAPK1 P28482 1/20 0.30
ESR1 P03372 1/20 0.30

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
SCHEMBL8430254 1.00 TSHR (0.55) TSHRTHRBTDP1POLBAPEX1
SCHEMBL3670738 0.96 TSHR (0.47) TSHRTHRBTDP1POLBAPEX1
SCHEMBL8636772 0.95 TSHR (0.50) TSHRTHRBTDP1POLBAPEX1
SCHEMBL7253549 0.95 TSHR (0.50) TSHRTHRBTDP1POLBAPEX1
SCHEMBL2223012 0.93 TSHR (0.48) TSHRTHRBTDP1POLBAPEX1
SCHEMBL3075214 0.93 TSHR (0.51) TSHRTHRBTDP1POLBAPEX1
Butadiene SCHEMBL8956976 0.91 TSHR (0.44) TSHRTHRBTDP1POLBAPEX1
SCHEMBL10885382 0.91 TSHR (0.47) TSHRTHRBTDP1POLBAPEX1
SCHEMBL8389317 0.91 THRB (0.55) TSHRTHRBTDP1POLBAPEX1
SCHEMBL1179097 0.90 TSHR (0.46) TSHRTHRBTDP1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518225-B2 Aqueous pigmented inks for ink jet printers DU PONT (US) 1999-10-20 EP disclosed
US-5946012-A Reliable high performance drop generator for an inkjet printhead HEWLETT-PACKARD CO. (US) 1999-08-31 US disclosed
US-5874974-A Reliable high performance drop generator for an inkjet printhead HEWLETT-PACKARD COMPANY (US) 1999-02-23 US disclosed
US-5851590-A Ink jet inks containing polyacrylamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-12-22 US disclosed
EP-0633914-B1 An aqueous ink composition DU PONT (US) 1998-10-21 EP disclosed
EP-0672538-B1 Reactive media-ink system for ink jet printing DU PONT (US) 1998-09-02 EP disclosed
US-5712338-A AQUEOUS CARRIER, BLOCK POLYMER DISPERSANT, REDUCED CRACKING, STORAGE STABILITY, LESS BLEEDING IN MULTICOLOR APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-01-27 US disclosed
EP-0565709-B1 AQUEOUS INK JET INKS CONTAINING POLYOL/ALKYLENE OXIDE CONDENSATES AS COSOLVENTS DU PONT (US) 1996-11-13 EP disclosed
EP-0714960-A1 Ink jet inks containing mixtures of alcohols E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-06-05 EP disclosed
EP-0672538-A1 Reactive media-ink system for ink jet printing E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-09-20 EP disclosed
US-5180425-A Aqueous ink jet inks containing polyol/alkylene oxide condensates as cosolvents E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-01-19 US disclosed
WO-1992022614-A1 PENETRANTS FOR AQUEOUS INK JET INKS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-23 WO disclosed
US-5173112-A Nonplugging, improved storage stability E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-22 US disclosed
EP-0518225-A1 Aqueous pigmented inks for ink jet printers E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-16 EP disclosed
US-5169436-A Aqueous carrier medium, colorant and water soluble sulfoxide or sulfone; rapid drying, excellent image definition, storage stable, nonplugging E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-08 US disclosed
US-5169438-A Storage stability, quick-drying E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-08 US disclosed
US-5160372-A Rapid drying; excellent decap performance; storage stable; good print quality images E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-03 US disclosed
EP-0509109-A1 Aqueous pigmented inks for ink jet printers E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-21 EP disclosed
US-5141556-A Branched diols or hexene-1,2-diols along with a pigment or dye; rapid drying; storage stability; quality; thermal printers E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-25 US disclosed
US-5085698-A Aqueous pigmented inks for ink jet printers E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-02-04 US disclosed