SCHEMBL10883126

SCHEMBL10883126

C=Cc1ccc(N2C(=O)C=CC2=O)c(OC)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 2/20 0.64
G6PD P11413 1/20 0.64
MGLL Q99685 3/20 0.56
TRPA1 O75762 1/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 2/20 0.51
MAPK1 P28482 2/20 0.51
HSP90AA1 P07900 1/20 0.51
PKM P14618 1/20 0.51
RAB9A P51151 1/20 0.51
CCR6 P51684 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
ALDH1A3 P47895 1/20 0.44
TSHR P16473 2/20 0.40
SRD5A1 P18405 1/20 0.38
PAX8 Q06710 1/20 0.38
NR1H3 Q13133 3/20 0.37

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
SCHEMBL31179956 0.80 TLR9 (0.72) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL14656898 0.78 G6PD (0.70) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL9837865 0.77 TLR9 (0.68) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL8973467 0.76 MGLL (0.53) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL10884013 0.75 TLR9 (0.60) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL10885514 0.75 TLR9 (0.41) TLR9G6PDMGLLTRPA1ALDH1A1
SCHEMBL24939679 0.73 G6PD (0.62) TLR9G6PDMGLLALDH1A1MAPT
SCHEMBL10883347 0.73 ALDH1A1 (0.40) TLR9G6PDMGLLTRPA1ALDH1A1
SCHEMBL29778007 0.73 TRPA1 (0.68) TRPA1ALDH1A1MAPTMAPK1TSHR
SCHEMBL33786 0.73 TRPA1 (0.68) TRPA1ALDH1A1MAPTMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0077840-B1 CURABLE RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-07-02 EP disclosed
US-4506042-A MOLDING, LAMINATION, VARISH MITSUI TOATSU CHEMICALS, INC. (JP) 1985-03-19 US disclosed
US-4401777-A Curable resin composition comprising N-(alkenylphenyl)maleimide and epoxy composition MITSUI TOATSU CHEMICALS, INC. (JP) 1983-08-30 US disclosed
EP-0077840-A1 Curable resin composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1983-05-04 EP disclosed