SCHEMBL8768883

SCHEMBL8768883

Cc1ccc(C(CO)OP(O)O)cc1.OCC(OP(O)O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.42
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASR P41180 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
TRPA1 O75762 2/20 0.36
SLC6A9 P48067 1/20 0.36
PKM P14618 1/20 0.35

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
SCHEMBL1028830 0.93 MAPT (0.35) GSRLMNAALDH1A1SMN1; SMN2KMT2A
SCHEMBL1032667 0.89 GSR (0.50) GSRLMNASMN1; SMN2KDM4ENPSR1
SCHEMBL1031797 0.79 SLC6A2 (0.35) ALDH1A1SLC6A2SLC6A4
SCHEMBL11277525 0.77 LMNA (0.47) GSRLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL3976067 0.76 SLC6A9 (0.52) GSRLMNACNR1MEN1KMT2A
SCHEMBL1031763 0.75 TRPA1 (0.42) GSRLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL1032014 0.75 LMNA (0.44) LMNASMN1; SMN2SLC6A9
SCHEMBL7019079 0.74 CNR1 (0.49) LMNAALDH1A1CNR1CNR2SMN1; SMN2
SCHEMBL1261774 0.72 CHRNA7 (0.37) GSRLMNAALDH1A1SMN1; SMN2SLC6A2
SCHEMBL13345096 0.72 AOC3 (0.38) GSRALDH1A1SLC6A2SLC6A4PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0791634-A2 Fire retardant polyester resin composition and process for producing the same Mitsubishi Engineering Plastics Corporation (JP) 1997-08-27 EP disclosed