SCHEMBL8429694

SCHEMBL8429694

CCOCCc1ccccc1C[NH]

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MYC P01106 5/20 0.38
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL10779393 0.80 MYC (0.40) MYCMAPTNPSR1L3MBTL1CYP4F2
SCHEMBL8142708 0.79 TSHR (0.38) MAPTKDM4EALDH1A1IDO1
SCHEMBL9179867 0.77 SLC6A4 (0.45) MYCLMNAALDH1A1
SCHEMBL283609 0.76 ADRA2B (0.39) LMNAKDM4EALDH1A1
SCHEMBL23616842 0.76 TAAR1 (0.50) IDO1
SCHEMBL31703386 0.76 TAAR1 (0.50) IDO1
SCHEMBL9149663 0.76 ALDH1A1 (0.44) MYCMAPTNPSR1L3MBTL1RAB9A
SCHEMBL11051055 0.73 CYP1A2 (0.47) KDM4E
SCHEMBL15899163 0.73 THRA (0.44) MAPTNPSR1L3MBTL1CYP4F2CYP4A11
SCHEMBL41744 0.72 LIPG (0.47) SMN1; SMN2KDM4E

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-0957135-A1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1999-11-17 EP disclosed