SCHEMBL12296378

SCHEMBL12296378

C1=CC(Oc2ccccc2)CC=C1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.37
TSHR P16473 1/20 0.37
SLC6A2 P23975 4/20 0.33
SLC6A3 Q01959 4/20 0.33
SLC6A4 P31645 3/20 0.33
HRH1 P35367 1/20 0.33
HTR1A P08908 1/20 0.33
KDM1A O60341 3/20 0.32
NR1H2 P55055 1/20 0.31
BAX Q07812 1/20 0.31
MAOA P21397 1/20 0.31
SOS1 Q07889 1/20 0.30

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
SCHEMBL21540196 0.89
SCHEMBL10280182 0.81 LTA4H (0.39) LTA4HTSHRSLC6A2SLC6A3SLC6A4
SCHEMBL21335984 0.79 ALDH1A1 (0.39) LTA4HTSHR
SCHEMBL18059368 0.77 SLC6A2 (0.35) SLC6A2SLC6A3SLC6A4HRH1MAOA
SCHEMBL18727509 0.77 SLC6A2 (0.35) SLC6A2SLC6A3SLC6A4HRH1MAOA
SCHEMBL18404277 0.77 LTA4H (0.38) LTA4HTSHRSLC6A2SLC6A3SLC6A4
SCHEMBL14618872 0.77 LTA4H (0.38) LTA4HTSHRSLC6A2SLC6A3SLC6A4
SCHEMBL14401546 0.77 HRH1 (0.34) SLC6A2SLC6A3SLC6A4HRH1
SCHEMBL18726466 0.77 HRH1 (0.34) LTA4HSLC6A2SLC6A3SLC6A4HRH1
SCHEMBL13366496 0.73 CA1 (0.37) LTA4HTSHRKDM1ANR1H2BAX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3560968-A1 COMPOSITION, CURED PRODUCT AND LAMINATE DIC Corporation (JP) 2019-10-30 EP disclosed
WO-2012175965-A2 POLYMERIC MATERIALS INVIBIO LIMITED (GB) 2012-12-27 WO disclosed
WO-2012107753-A1 PIPE VICTREX MANUFACTURING LIMITED (GB) 2012-08-16 WO disclosed
WO-2011117631-A1 MEDICAL DEVICE INVIBIO LIMITED (GB) 2011-09-29 WO disclosed
WO-2011117607-A1 METHOD OF PRUDICNG A COMPOSITE PIPE AND SUCH A COMPOSITE PIPE VICTREX MANUFACTURING LIMITED (GB) 2011-09-29 WO disclosed
WO-2011001187-A1 ENCLOSURE INVIBIO LIMITED (GB) 2011-01-06 WO disclosed
WO-2010122326-A1 POLYMERIC MATERIALS COMPRISING BARIUM SULPHATE INVIBIO LIMITED (GB) 2010-10-28 WO disclosed
WO-2010043888-A1 POLYMERIC MATERIALS VICTREX MANUFACTURING LIMITED (GB) 2010-04-22 WO disclosed