SCHEMBL1301580

SCHEMBL1301580

CC(=O)OCC(=O)c1ccccc1C

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.54
ERCC5 P28715 1/20 0.51
FEN1 P39748 1/20 0.51
ALDH1A1 P00352 5/20 0.46
HSD17B10 Q99714 2/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
CTNNB1 P35222 6/20 0.45
WNT3A P56704 6/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL31410660 0.82 CTNNB1 (0.50) SMN1; SMN2ERCC5FEN1ALDH1A1TSHR
SCHEMBL24233351 0.81 ERCC5 (0.55) LMNAERCC5FEN1ALDH1A1HSD17B10
SCHEMBL4637854 0.80 LMNA (0.53) SMN1; SMN2LMNAERCC5FEN1ALDH1A1
SCHEMBL27455653 0.80 ALDH1A1 (0.54) SMN1; SMN2LMNAALDH1A1HSD17B10TSHR
SCHEMBL11758235 0.79 HSD11B1 (0.48) SMN1; SMN2LMNAALDH1A1TSHRKMT2A
SCHEMBL11754009 0.79 MAPT (0.58) SMN1; SMN2LMNAALDH1A1HSD17B10TSHR
SCHEMBL8142406 0.79 PTGS2 (0.61) LMNAALDH1A1HSD17B10TSHRKMT2A
SCHEMBL13183392 0.78 SMN1; SMN2 (0.48) SMN1; SMN2LMNAERCC5FEN1ALDH1A1
SCHEMBL4529398 0.77 LMNA (0.50) SMN1; SMN2LMNAALDH1A1HSD17B10TSHR
SCHEMBL4828442 0.77 NPC1 (0.59) SMN1; SMN2LMNAALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015128428-A1 PHEROMONE DISPENSER MADE OF PLASTIC MATERIAL BASF SE (DE) 2015-09-03 WO disclosed
CN-102271498-A Pheromone dispenser 2011-12-07 CN disclosed
EP-2384111-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-09 EP disclosed
US-20110266361-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-03 US disclosed
WO-2010076316-A1 PHEROMONE DISPENSER BASF SE (DE) 2010-07-08 WO disclosed