SCHEMBL7550301

SCHEMBL7550301

CCCCCCOc1c(CCCC)ccc(C(=O)O)c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 7/20 0.46
CNR2 P34972 1/20 0.43
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PLK1 P53350 1/20 0.42
RARB P10826 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NR1I2 O75469 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HDAC6 Q9UBN7 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
SCHEMBL28360757 0.81 GABRP (0.43) CNR2TSHRRARBMEN1KMT2A
SCHEMBL368881 0.80 BID (0.50) PTPN11LMNATSHRALDH1A1
SCHEMBL10535050 0.79 PTPN11 (0.60) PTPN11CNR2LMNAALDH1A1MEN1
SCHEMBL9588303 0.78 CNR2 (0.42) PTPN11CNR2TSHRRARB
SCHEMBL9587207 0.78 CNR2 (0.42) PTPN11CNR2TSHRRARB
SCHEMBL5453797 0.78 BID (0.54) PTPN11TSHR
SCHEMBL2374613 0.78 BID (0.54) PTPN11TSHR
SCHEMBL10592243 0.78 BID (0.54) PTPN11TSHR
SCHEMBL7078027 0.78 BID (0.54) PTPN11TSHR
SCHEMBL11868801 0.78 BID (0.54) PTPN11TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216433-A1 LIQUID CRYSTAL DEVICE AND DISPLAY Sharp Laboratories of Europe Limited (GB) 2002-06-26 EP disclosed
WO-2001023953-A1 LIQUID CRYSTAL DEVICE AND DISPLAY SHARP LABORATORIES OF EUROPE LIMITED (GB) 2001-04-05 WO disclosed