SCHEMBL6232093

SCHEMBL6232093

C=CC(=O)NC(C)(CC)CCCC(C)C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 4/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL9398466 0.92 TSHR (0.37) CYP3A4MEN1KMT2AALOX15TSHR
SCHEMBL8764497 0.85 ZDHHC20 (0.44) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL7115211 0.81 MEN1 (0.48) CYP3A4MEN1KMT2AALOX15TSHR
SCHEMBL8765395 0.81 TSHR (0.39) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL8764635 0.81 ALDH1A1 (0.40) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL8766016 0.81 ZDHHC20 (0.41) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL4909167 0.80 ALDH1A1 (0.44) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL21728872 0.80 ALDH1A1 (0.39) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL6233259 0.77 MEN1 (0.33) CYP3A4MEN1KMT2AALOX15TSHR
SCHEMBL12607569 0.77 MEN1 (0.33) CYP3A4MEN1KMT2ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220145116-A1 AQUEOUS COATING COMPOSITION ALLNEX NETHERLANDS (NL) 2022-05-12 US disclosed
EP-3935113-A1 AQUEOUS COATING COMPOSITION Allnex Netherlands B.V. (NL) 2022-01-12 EP disclosed
US-6916862-B2 Process for the preparation of pigment dispersion, pigment dispersion obtained by the same, ink jet recording ink comprising the same, and recording method and recorded material using the same SEIKO EPSON CORPORATION (JP) 2005-07-12 US disclosed
EP-0857766-B1 Process for producing aqueous ink for inkjet printing KAO CORP (JP) 2005-04-20 EP disclosed
US-6617389-B1 Terpolymers of an unsaturated carboxylic acid, another unsaturated monomer and a nitrogenous adhesion promoting, copolymerizable monomer;high gloss topcoats AKZO NOBEL N.V. (NL) 2003-09-09 US disclosed
EP-1245652-A1 Aqueous ink for inkjet printing Kao Corporation (JP) 2002-10-02 EP disclosed
US-20020075369-A1 Process for the preparation of pigment dispersion, pigment dispersion obtained by the same, ink jet recording ink comprising the same, and recording method and recorded material using the same SEIKO EPSON CORPORATION 2002-06-20 US disclosed
EP-1146090-A2 Process for the preparation of pigment dispersion, pigment dispersion obtained by the same, ink jet recording ink comprising the same, and recording method and recording material using the same SEIKO EPSON CORPORATION (JP) 2001-10-17 EP disclosed
EP-0927198-B1 AQUEOUS POLYMER DISPERSION FOR USE IN WATER BASED GLOSSY LACQUERS AKZO NOBEL NV (NL) 2001-05-23 EP disclosed
US-5998501-A DISSOLVING POLYMER AND HYDROPHOBIC DYE IN WATER INSOLUBLE SOLVENT; ADDING WATER AND NEUTRALIZING AGENT; EMULSIFICATION; DESOLVENTIZING KAO CORPORATION (JP) 1999-12-07 US disclosed
EP-0927198-A1 AQUEOUS POLYMER DISPERSION FOR USE IN WATER BASED GLOSSY LACQUERS Akzo Nobel N.V. (NL) 1999-07-07 EP disclosed
US-5852074-A Aqueous ink for inkjet printing KAO CORPORATION (JP) 1998-12-22 US disclosed
EP-0857766-A1 Process for producing aqueous ink for inkjet printing KAO CORPORATION (JP) 1998-08-12 EP disclosed
WO-1998012230-A1 AQUEOUS POLYMER DISPERSION FOR USE IN WATER BASED GLOSSY LACQUERS AKZO NOBEL N.V. (NL) 1998-03-26 WO disclosed
EP-0791610-A2 Aqueus ink for inkjet printing KAO CORPORATION (JP) 1997-08-27 EP disclosed