SCHEMBL8556449

SCHEMBL8556449

CC(=O)OCc1csc2nc(-c3ccc(Cl)cc3)cn12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.53
TP53 P04637 5/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 5/20 0.43
ABL1 P00519 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
ENPP2 Q13822 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
EGFR P00533 1/20 0.40
AKT1 P31749 1/20 0.40

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
SCHEMBL8556548 0.76 THRB (0.53) THRBTP53MAPTEGFRAKT1
SCHEMBL3668984 0.74 MAPT (0.59) THRBTP53NPC1RAB9AMAPT
SCHEMBL8554248 0.70 MAPT (0.43) THRBTP53MAPTKDM4EMEN1
SCHEMBL16399502 0.69 GFER (0.57) THRBTP53NPC1RAB9AL3MBTL1
SCHEMBL8553030 0.69 THRB (0.42) THRBTP53NPC1RAB9AMAPT
Bromide SCHEMBL30852751 0.69 MAPT (0.57) THRBTP53NPC1RAB9AMAPT
SCHEMBL8553036 0.69 THRB (0.42) THRBTP53NPC1RAB9AMAPT
SCHEMBL8555297 0.68 THRB (0.43) THRBTP53MAPTABL1RXFP1
SCHEMBL9348088 0.68 THRB (0.41) THRBTP53NPC1RAB9ATDP1
SCHEMBL30852733 0.67 MAPT (0.52) THRBTP53NPC1RAB9AMAPT

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-0554957-B1 Thiazole derivatives of alkoxyacrylates with a fungicidal activity MINI RICERCA SCIENT TECNOLOG (IT) 1998-04-15 EP disclosed
EP-0554957-A2 Thiazole derivatives of alkoxyacrylates with a fungicidal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1993-08-11 EP disclosed