SCHEMBL9152803

SCHEMBL9152803

CCCCCCOc1ccccc1C1(O)C=CC(C(=O)O)C=C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
LMNA P02545 1/20 0.47
CHRM2 P08172 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADRA2A P08913 1/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
CYSLTR2 Q9NS75 2/20 0.42
CYSLTR1 Q9Y271 2/20 0.42
PLA2G4B P0C869 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FAAH O00519 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
PTPN11 Q06124 1/20 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
SCHEMBL9330548 0.95 KDM4E (0.40) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL10340810 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9485458 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8374332 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL11138412 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9511116 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9640129 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9486045 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9650375 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9485380 0.86 MEN1 (0.45) MEN1NR1I2LMNACHRM2CYP3A4

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
US-5395910-A Photostable polymers AKZO NOBEL N.V. (NL) 1995-03-07 US disclosed
EP-0550105-A2 Liquid-crystalline polyurethanes, compositions of said liquid-crystalline polyurethanes, and a device for optical data storage comprising a liquid-crystalline polyurethane Akzo Nobel N.V. (NL) 1993-07-07 EP disclosed