SCHEMBL1666993

SCHEMBL1666993

CCCCCCCCCCCCCCC(=O)CN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 2/20 0.47
THRB P10828 5/20 0.47
THRA P10827 2/20 0.47
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
PAOX Q6QHF9 1/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 2/20 0.44
NAAA Q02083 1/20 0.44
MEN1 O00255 3/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
HIF1A Q16665 1/20 0.43
UGCG Q16739 1/20 0.43

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
SCHEMBL8524266 1.00 HSD17B10 (0.47) HSD17B10KDM4ETHRBTHRAALOX15
SCHEMBL14198492 1.00 HSD17B10 (0.47) HSD17B10KDM4ETHRBTHRAALOX15
SCHEMBL14198493 1.00 HSD17B10 (0.47) HSD17B10KDM4ETHRBTHRAALOX15
SCHEMBL14198494 0.98 HSD17B10 (0.48) HSD17B10KDM4ETHRBTHRAALOX15
SCHEMBL12897872 0.85 PAOX (0.54) THRBTHRAPAOXKMT2AMAPT
SCHEMBL8524267 0.83 THRB (0.53) THRBTHRAPAOXKMT2AMAPT
SCHEMBL1144527 0.82 L3MBTL1 (0.47) HSD17B10ALOX15TSHRKMT2AMAPT
Water SCHEMBL27813121 0.81 THRB (0.52) THRBTHRAPAOXKMT2AMAPT
SCHEMBL17829513 0.80 THRB (0.43) THRBTHRAPAOXKMT2AMAPT
SCHEMBL7983147 0.79 GNAI3 (0.54) KMT2AMAPTNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621713-B1 DEVICE AND METHOD FOR THE PRODUCTION OF 3D STRUCTURES IN LAYERS, AND USE THEREOF FRAUNHOFER GES FORSCHUNG (DE) 2015-09-23 EP claimed
EP-2482815-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES Avexxin AS (NO) 2012-08-08 EP disclosed
WO-2011039365-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES AVEXXIN AS (NO) 2011-04-07 WO disclosed