SCHEMBL22702010

SCHEMBL22702010

C=CC(=O)NC(C)(C)C(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.44
KDM4E B2RXH2 1/20 0.44
THRB P10828 2/20 0.40
ALDH1A1 P00352 4/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
MMP8 P22894 2/20 0.38
MAPK1 P28482 2/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35

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
SCHEMBL26478900 0.86 TSHR (0.38) PKMKDM4ETHRBALDH1A1CYP3A4
SCHEMBL582900 0.84 MAPT (0.39) ALDH1A1CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL14007854 0.83 TSHR (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
SCHEMBL17995995 0.81 ALDH1A1 (0.36) ALDH1A1CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL26478904 0.81 TSHR (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19MMP8
SCHEMBL26478906 0.80 ZDHHC20 (0.46) THRBALDH1A1CYP3A4TSHRZDHHC20
SCHEMBL26478897 0.80 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL2032975 0.78 TSHR (0.55) THRBALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL10978457 0.77 ALDH1A1 (0.34) THRBALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL583346 0.77 TSHR (0.37) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135413-A1 CURABLE WATER-BASED COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE WATER-BASED COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE WATER-BASED INK, STORED CONTAINER, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING APPARATUS, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING METHOD, CURED PRODUCT, AND DECORATED BODY RICOH COMPANY, LTD. (JP) 2023-05-04 US disclosed
US-20230135413-A1 CURABLE WATER-BASED COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE WATER-BASED COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE WATER-BASED INK, STORED CONTAINER, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING APPARATUS, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING METHOD, CURED PRODUCT, AND DECORATED BODY RICOH COMPANY, LTD. (JP) 2023-05-04 US disclosed
US-20200368694-A1 POLYMERIC SUBSTRATES WITH ATTACHED POLYMERIC CHAINS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2020-11-26 US disclosed
CN-100513462-C Foam including surface-modified nanoparticles 3M INNOVATIVE PROPERTIES CO (US) 2009-07-15 CN disclosed
CN-101233183-A Self-extinguishing polymer composition 3M INNOVATIVE PROPERTIES CO (US) 2008-07-30 CN disclosed
CN-101094885-A Polymer blends including surface-modified nanoparticles and methods of making the same 3M INNOVATIVE PROPERTIES CO (US) 2007-12-26 CN disclosed
CN-1503819-A Foam including surface-modified nanoparticles 3M 2004-06-09 CN disclosed