SCHEMBL4424463

SCHEMBL4424463

C=CCC(CC=C)(C(=O)O)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HCAR2 Q8TDS4 1/20 0.35
MAPK1 P28482 1/20 0.35
PKM P14618 3/20 0.35
PIN1 Q13526 1/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
THRB P10828 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL6451149 0.93 MEN1 (0.40) MEN1KMT2AHCAR2MAPK1PKM
SCHEMBL283884 0.90 MEN1 (0.46) MEN1KMT2AHCAR2MAPK1PKM
SCHEMBL3519692 0.86 MEN1 (0.43) MEN1KMT2AMAPK1PKMPIN1
SCHEMBL20988282 0.85 MEN1 (0.43) MEN1KMT2AHCAR2PKMALDH1A1
SCHEMBL4740338 0.85 MEN1 (0.42) MEN1KMT2AMAPK1PKMALDH1A1
SCHEMBL30608352 0.84 MEN1 (0.34) MEN1KMT2AMAPK1
SCHEMBL28559339 0.83 MEN1 (0.44) MEN1KMT2AMAPK1PKMALDH1A1
SCHEMBL10556756 0.82 CYP3A4 (0.36) MEN1KMT2APKMALDH1A1SMN1; SMN2
SCHEMBL6287321 0.82 MEN1 (0.41) MEN1KMT2AMAPK1PKMPIN1
SCHEMBL12933672 0.81 MEN1 (0.40) MEN1KMT2AHCAR2MAPK1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2825522-A1 RUTHENIUM-BASED METATHESIS CATALYSTS AND PRECURSORS FOR THEIR PREPARATION Umicore AG & Co. KG (DE) 2015-01-21 EP disclosed
WO-2013135776-A1 RUTHENIUM-BASED METATHESIS CATALYSTS AND PRECURSORS FOR THEIR PREPARATION UMICORE AG & CO. KG (DE) 2013-09-19 WO disclosed
US-7511179-B2 Fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. (JP) 2009-03-31 US disclosed
US-20060251991-A1 Novel fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. 2006-11-09 US disclosed
US-7115690-B2 Fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. (JP) 2006-10-03 US disclosed
US-20060204893-A1 Novel fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. 2006-09-14 US disclosed
US-20040191680-A1 Novel fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. 2004-09-30 US disclosed
EP-1449860-A1 NOVEL FLUOROPOLYMER, RESIST COMPOSITIONS CONTAINING THE SAME, AND NOVEL FLUOROMONOMERS Daikin Industries, Ltd. (JP) 2004-08-25 EP disclosed
US-6426419-B1 ACTIVE AT HIGH TEMPERATURES, STABLE TOWARDS OXYGEN AND MOISTURE CALIFORNIA INSTITUTE OF TECHNOLOGY 2002-07-30 US disclosed
EP-1180108-A2 IMIDAZOLIDINE-BASED METAL CARBENE METATHESIS CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2002-02-20 EP disclosed
WO-2000071554-A2 IMIDAZOLIDINE-BASED METAL CARBENE METATHESIS CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-11-30 WO disclosed