SCHEMBL720047

SCHEMBL720047

CCC(C)C(OC(=O)c1ccccc1)C(CC)(CC)COC(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
HIF1A Q16665 1/20 0.49
TDP1 Q9NUW8 3/20 0.45
CYP2D6 P10635 3/20 0.45
SLC6A3 Q01959 2/20 0.45
HTR1A P08908 1/20 0.45
SCN1A P35498 1/20 0.45
SCN5A Q14524 1/20 0.45
SCN2A Q99250 1/20 0.45
SCN3A Q9NY46 1/20 0.45
LMNA P02545 3/20 0.44
ALDH1A1 P00352 3/20 0.41
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
ADRB3 P13945 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 2/20 0.40

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
SCHEMBL17583004 0.86 MAPK1 (0.48) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL722544 0.84 MAPK1 (0.51) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL1786955 0.77 CYP2D6 (0.49) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL720787 0.75 MAPK1 (0.54) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL18543927 0.74 TDP1 (0.46) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL16225017 0.74 TSHR (0.52) TDP1CYP2D6SCN1ASCN2ASCN3A
SCHEMBL13447348 0.74 TSHR (0.52) TDP1CYP2D6SCN1ASCN2ASCN3A
SCHEMBL29580263 0.74 TSHR (0.52) TDP1CYP2D6SCN1ASCN2ASCN3A
SCHEMBL235921 0.73 MAPK1 (0.81) MAPK1HIF1ATDP1CYP2D6SLC6A3
SCHEMBL560900 0.72 MAPK1 (0.54) MAPK1HIF1ATDP1CYP2D6SLC6A3

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-4739409-A1 MODELLING MATERIAL AND METHOD FOR THE PRODUCTION THEREOF STAEDTLER SE (DE) 2026-05-13 EP disclosed
WO-2025011772-A1 MODELLING MATERIAL AND METHOD FOR THE PRODUCTION THEREOF STAEDTLER SE (DE) 2025-01-16 WO disclosed
EP-4146726-A1 METHOD FOR PRODUCING A MOLDING COMPOUND STAEDTLER Mars GmbH & Co. KG (DE) 2023-03-15 EP disclosed
EP-4146732-A1 MODELING MATERIAL AND METHOD FOR THE PRODUCTION THEREOF STAEDTLER Mars GmbH & Co. KG (DE) 2023-03-15 EP disclosed
US-8481235-B2 Pentanediol ester containing photoconductors XEROX CORPORATION (US) 2013-07-09 US disclosed
US-20130066000-A1 MODELLING MATERIAL AND ITS USE J.S. STAEDTLER GMBH & CO. KG (DE) 2013-03-14 US disclosed
US-20120052428-A1 PENTANEDIOL ESTER CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2012-03-01 US disclosed
EP-1957572-B1 MODELING COMPOSITION AND ITS USE STAEDTLER J S GMBH & CO KG (DE) 2011-10-26 EP disclosed
EP-1957572-A1 MODELING COMPOSITION AND ITS USE J.S. Staedtler GmbH & Co KG (DE) 2008-08-20 EP disclosed
WO-2007065675-A1 MODELING COMPOSITION AND ITS USE J.S. STAEDTLER GMBH & CO. KG (DE) 2007-06-14 WO disclosed
US-20070135562-A1 Modelling material and its use J. S. STAEDTLER GMBH & CO. 2007-06-14 US disclosed