SCHEMBL432620

SCHEMBL432620

O=C(CCS)OCCOCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 4/20 0.42
MAPK1 P28482 1/20 0.42
EPHX2 P34913 1/20 0.40
DGKA P23743 1/20 0.36
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPT P10636 2/20 0.33
BLM P54132 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
MGLL Q99685 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 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
SCHEMBL6036438 1.00 MEN1 (0.46) MEN1KMT2ATSHRMAPK1EPHX2
SCHEMBL27776824 1.00 MEN1 (0.46) MEN1KMT2ATSHRMAPK1EPHX2
SCHEMBL98263 0.91 DGKA (0.41) TSHREPHX2DGKAALDH1A1TP53
SCHEMBL98157 0.91 DGKA (0.41) TSHREPHX2DGKAALDH1A1TP53
SCHEMBL98818 0.91 DGKA (0.41) TSHREPHX2DGKAALDH1A1TP53
SCHEMBL28847856 0.88 EPHX2 (0.45) MEN1KMT2ATSHRMAPK1EPHX2
SCHEMBL15426704 0.87 DGKA (0.39) TSHREPHX2DGKAALDH1A1TP53
SCHEMBL718982 0.87
SCHEMBL21876951 0.87 MEN1 (0.55) MEN1KMT2ATSHRMAPK1EPHX2
SCHEMBL21055107 0.87 MEN1 (0.55) MEN1KMT2ATSHRMAPK1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3931234-B1 STORAGE STABLE PIGMENTED ISOCYANATE GROUP-CONTAINING FORMULATIONS COMPRISING ISOCYANATE GROUP-CONTAINING RUBBING RESIN AND THEIR USE COVESTRO DEUTSCHLAND AG (DE) 2025-10-15 EP disclosed
EP-3841141-B1 A COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF COVESTRO DEUTSCHLAND AG (DE) 2025-01-01 EP disclosed
EP-4277941-B1 COMPOSITIONS CONTAINING URETDIONE GROUPS COVESTRO DEUTSCHLAND AG (DE) 2025-01-01 EP disclosed
EP-3601405-B1 GENERATION OF POLYISOCYANURATE LAYERS THROUGH SEPARATE APPLICATION OF ISOCYANATE COMPONENTS AND CATALYSTS COVESTRO DEUTSCHLAND AG (DE) 2024-08-28 EP disclosed
US-11965108-B2 Composition, preparation method and application thereof COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-04-23 US disclosed
US-11965054-B2 Storage-stable pigmented isocyanate group-containing formulations with isocyanate group-containing grinding resin and use thereof COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-04-23 US disclosed
EP-3129353-B1 METHOD FOR MANUFACTURING XYLYLENE DIISOCYANATES IN THE GASEOUS PHASE COVESTRO DEUTSCHLAND AG (DE) 2024-02-28 EP disclosed
US-11827738-B2 Thiol-ene-curing compositions MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2023-11-28 US disclosed
EP-4277941-A1 COMPOSITIONS COMPRISING URETDIONES Covestro Deutschland AG (DE) 2023-11-22 EP disclosed
CN-113518791-B Storage-stable pigment-containing isocyanate-group-containing formulations having an isocyanate-group-containing grinding resin and use thereof 科思创知识产权两合公司 2023-08-08 CN disclosed
WO-2012010524-A1 POLYURETHANE HAVING LOW VOLUME SHRINKAGE BAYER MATERIALSCIENCE AG (DE) 2012-01-26 WO disclosed
WO-2012010523-A1 POLYISOCYANATE MIXTURES BAYER MATERIALSCIENCE AG (DE) 2012-01-26 WO disclosed
US-20110281966-A1 POLYURETHANE SEALING COMPOUNDS COVESTRO DEUTSCHLAND AG (DE) 2011-11-17 US disclosed
US-20110281965-A1 POLYURETHANE CASTING COMPOUNDS Bayer MateialScience AG (DE) 2011-11-17 US disclosed
US-7932327-B2 Polyurethane/thiourethane-based optical resin and process for producing the same MITSUI CHEMICALS, INC. (JP) 2011-04-26 US disclosed
EP-1923415-B1 POLYURETHANE/THIOURETHANE-BASED OPTICAL RESIN AND PROCESS FOR PRODUCING THE SAME MITSUI CHEMICALS INC (JP) 2010-12-08 EP disclosed
US-20090227745-A1 Polyurethane/thiourethane-based optical resin and process for producing the same MITSUI CHEMICALS, INC. (JP) 2009-09-10 US disclosed
US-20090099329-A1 Polythiourethane-based polymerizable composition and optical resin obtained from the same MITSUI CHEMICALS, INC. (JP) 2009-04-16 US disclosed
EP-1925629-A1 POLYTHIOURETHANE-BASED POLYMERIZABLE COMPOSITION AND OPTICAL RESIN OBTAINED FROM THE SAME Mitsui Chemicals, Inc. (JP) 2008-05-28 EP disclosed
EP-1923415-A1 POLYURETHANE/THIOURETHANE-BASED OPTICAL RESIN AND PROCESS FOR PRODUCING THE SAME Mitsui Chemicals, Inc. (JP) 2008-05-21 EP disclosed