SCHEMBL1994076

SCHEMBL1994076

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

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 3/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
THRB P10828 1/20 0.32
ACACB O00763 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PKM P14618 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
SCHEMBL3376906 0.82 ALDH1A1 (0.38) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL2779247 0.78 ALDH1A1 (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL2792549 0.77 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL4909167 0.75 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL28537745 0.74 ALDH1A1 (0.35) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL3319888 0.74 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL8766001 0.73 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL460924 0.71 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL1907643 0.71 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL17350190 0.69 ALDH1A1 (0.43) 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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716413-B2 Photocurable composition HUNTSMAN ADVANCED MATERIALS AMERICAS LLC (US) 2014-05-06 US disclosed
US-20110200950-A1 PHOTOCURABLE COMPOSITION HUNTSMAN INTERNATIONAL LLC (US) 2011-08-18 US disclosed
EP-2331599-A1 PHOTOCURABLE COMPOSITION Huntsman Advanced Materials (Switzerland) GmbH (CH) 2011-06-15 EP disclosed
WO-2010034531-A1 PHOTOCURABLE COMPOSITION HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2010-04-01 WO disclosed
EP-2168994-A1 Photocurable composition Huntsman Advanced Materials (Switzerland) GmbH (CH) 2010-03-31 EP disclosed
EP-1651695-B1 PHOTOCROSSLINKABLE POLYURETHANES HUNTSMAN ADV MAT SWITZERLAND (CH) 2009-01-21 EP disclosed
US-7476484-B2 Photocrosslinkable polyurethanes HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) 2009-01-13 US disclosed
US-7387812-B2 Telechelic polymers; improved adhesion properties, chemical stability, electrical properties and resistance to rapid temperature ranges; for use as solder resists in production of circuit boards HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) 2008-06-17 US disclosed
EP-1468041-B1 RESIN COMPOSITION HUNTSMAN ADV MAT SWITZERLAND (CH) 2007-05-30 EP disclosed
US-20060204895-A1 Photocrosslinkable polyurethanes HUNTSMAN ADVANCED MATERIALS AMERICA INC. (US) 2006-09-14 US disclosed
EP-1651695-A1 PHOTOCROSSLINKABLE POLYURETHANES Huntsman Advanced Materials (Switzerland) GmbH (CH) 2006-05-03 EP disclosed
EP-1458794-B1 HEAT-CURABLE RESIN COMPOSITION HUNTSMAN ADV MAT SWITZERLAND (CH) 2005-08-17 EP disclosed
WO-2005014682-A1 PHOTOCROSSLINKABLE POLYURETHANES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2005-02-17 WO disclosed
US-20050032935-A1 Telechelic polymers; improved adhesion properties, chemical stability, electrical properties and resistance to rapid temperature ranges; for use as solder resists in production of circuit boards HUNTSMAN ADVANCED MATERIALS AMERICAS, INC. 2005-02-10 US disclosed
US-20050032946-A1 Resin composition HUNTSMAN ADVANCED MATERIALS AMERICAS, INC. (US) 2005-02-10 US disclosed
EP-1468041-A1 RESIN COMPOSITION Huntsman Advanced Materials (Switzerland) GmbH (CH) 2004-10-20 EP disclosed
EP-1458794-A1 HEAT-CURABLE RESIN COMPOSITION Huntsman Advanced Materials (Switzerland) GmbH (CH) 2004-09-22 EP disclosed
WO-2003048235-A1 HEAT-CURABLE RESIN COMPOSITION VANTICO AG (CH) 2003-06-12 WO disclosed
WO-2003048234-A1 RESIN COMPOSITION VANTICO AG (CH) 2003-06-12 WO disclosed