SCHEMBL11206288

SCHEMBL11206288

N#Cc1ccc(O)n(-c2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 4/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
BCAT1 P54687 1/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 2/20 0.41
PGR P06401 1/20 0.40
TSHR P16473 1/20 0.40
PDE7A Q13946 2/20 0.39
PDE7B Q9NP56 2/20 0.39
MEN1 O00255 1/20 0.39
RECQL P46063 1/20 0.39
USP2 O75604 2/20 0.39
FEN1 P39748 1/20 0.39

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
SCHEMBL5759510 0.81 KDM4E (0.45) MAPK1ALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL1258272 0.77 KDM4E (0.49) MAPK1ALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL6210875 0.75 ALDH1A1 (0.46) ALDH1A1L3MBTL1KDM4EHPGDMAPT
SCHEMBL19377934 0.73 GRIA1 (0.50) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL7084390 0.72 GAA (0.44) MAPK1ALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL13249010 0.70 GSK3A (0.37) MAPK1ALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL5372425 0.70 LMNA (0.57) ALDH1A1L3MBTL1KDM4EHPGDMAPT
SCHEMBL11307956 0.69 KDM4E (0.53) ALDH1A1L3MBTL1KDM4EHPGDMAPT
SCHEMBL10059379 0.69 ATM (0.43) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL2782445 0.69 KDM4E (0.38) MAPK1ALDH1A1SMN1; SMN2L3MBTL1KDM4E

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
EP-0038439-B1 DYESTUFF MIXTURES, METHOD FOR THEIR PREPARATION, THE COMPONENT DYESTUFFS AND THEIR USE IN DYEING AND PRINTING SYNTHETIC, HYDROPHOBIC FIBRE MATERIAL CASSELLA Aktiengesellschaft (DE) 1983-05-04 EP disclosed
EP-0038439-A1 Dyestuff mixtures, method for their preparation, the component dyestuffs and their use in dyeing and printing synthetic, hydrophobic fibre material CASSELLA Aktiengesellschaft (DE) 1981-10-28 EP disclosed
US-4096145-A DYES FOR RESINS AND POLYESTER TEXTILES BASF AKTIENGESELLSCHAFT (DT) 1978-06-20 US disclosed