SCHEMBL9418786

SCHEMBL9418786

COc1ccccc1N1C(=O)C=CC1=O.O=C1C=CC(=O)N1c1ccccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.81
TLR9 Q9NR96 2/20 0.51
G6PD P11413 1/20 0.51
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
GAA P10253 3/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
CASP3 P42574 1/20 0.44
CASP6 P55212 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
HSP90AA1 P07900 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL141734 0.90 MGLL (1.00) MGLLTLR9G6PDKMT2AMEN1
SCHEMBL29439366 0.90 MGLL (1.00) MGLLTLR9G6PDKMT2AMEN1
SCHEMBL142504 0.84 TLR9 (0.70) MGLLTLR9KMT2AMEN1GAA
SCHEMBL29366386 0.84 TLR9 (0.70) MGLLTLR9KMT2AMEN1GAA
Formaldehyde SCHEMBL28487390 0.81 TLR9 (0.64) MGLLTLR9KMT2AMEN1GAA
SCHEMBL10769331 0.76 MGLL (0.73) MGLLTLR9G6PDKMT2AMEN1
SCHEMBL9320871 0.75 MGLL (0.71) MGLLTLR9G6PDALDH1A1HSP90AA1
SCHEMBL9837865 0.73 TLR9 (0.68) MGLLTLR9G6PDKMT2AMEN1
SCHEMBL9162087 0.73 MGLL (0.69) MGLLTLR9G6PDKMT2AMEN1
SCHEMBL11346699 0.73 MGLL (0.69) MGLLTLR9G6PDKMT2AMEN1

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-0379154-B1 Vinyl chloride resin composition MITSUBISHI RAYON CO (JP) 1994-08-10 EP disclosed
EP-0379154-A1 Vinyl chloride resin composition MITSUBISHI RAYON CO., LTD. (JP) 1990-07-25 EP disclosed