SCHEMBL19490331

SCHEMBL19490331

COc1ccc(-c2nc(-c3ccc(OC)cc3OC(C)=O)nc(-c3ccc(OC)cc3OC(C)=O)n2)c(OC)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 7/20 0.60
BACE1 P56817 1/20 0.56
ALDH1A1 P00352 1/20 0.51
F2 P00734 1/20 0.51
GLA P06280 1/20 0.51
HPGD P15428 1/20 0.51
TNFSF11 O14788 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
NPC1 O15118 1/20 0.49
ALPL P05186 1/20 0.47
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46

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
SCHEMBL6678654 0.85 CYP1A1 (0.58) ADORA3ALDH1A1KMT2AMEN1NPC1
SCHEMBL28215172 0.83 BACE1 (0.58) ADORA3BACE1ALDH1A1F2GLA
SCHEMBL8378539 0.81 NPC1 (0.66) ADORA3ALDH1A1KMT2AMEN1NPC1
SCHEMBL6681453 0.81 NPC1 (0.66) ADORA3ALDH1A1KMT2AMEN1NPC1
SCHEMBL28215694 0.79 BACE1 (0.50) ADORA3BACE1ALDH1A1F2GLA
SCHEMBL3327344 0.79 CA12 (0.63) BACE1ALDH1A1TNFSF11KMT2AMEN1
SCHEMBL3328971 0.79 TSHR (0.64) BACE1ALDH1A1TNFSF11KMT2AMEN1
SCHEMBL15005544 0.77 NPC1 (0.60) ADORA3ALDH1A1HPGDKMT2AMEN1
SCHEMBL11793587 0.77 BACE1 (0.61) BACE1ALDH1A1F2GLAHPGD
SCHEMBL8910814 0.76 ELANE (0.45) ADORA3BACE1ALDH1A1F2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11640110-B2 Resin composition, method for producing heat-resistant resin film, and display device TORAY INDUSTRIES, INC. (JP) 2023-05-02 US disclosed
US-20200192227-A1 RESIN COMPOSITION, METHOD FOR PRODUCING HEAT-RESISTANT RESIN FILM, AND DISPLAY DEVICE TORAY INDUSTRIES, INC. (JP) 2020-06-18 US disclosed
US-20170299965-A1 RESIN COMPOSITION, METHOD FOR PRODUCING HEAT-RESISTANT RESIN FILM, AND DISPLAY DEVICE TORAY INDUSTRIES, INC. (JP) 2017-10-19 US disclosed