SCHEMBL25713588

SCHEMBL25713588

C=CC(=O)OCCOCCOCCOc1cc(-c2nc3ccccc3s2)cc(-c2nc3ccccc3s2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.49
SMN1; SMN2 Q16637 5/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
KMT2A Q03164 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 7/20 0.43
RXFP1 Q9HBX9 3/20 0.43
RAB9A P51151 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
TP53 P04637 5/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
MIF P14174 1/20 0.41
ATP4A P20648 2/20 0.41

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
SCHEMBL25713737 0.89 THRB (0.46) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713617 0.86 SMN1; SMN2 (0.52) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713676 0.84 HDAC1 (0.47) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713526 0.84 THRB (0.44) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713616 0.82 KDM4E (0.54) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25711510 0.82 THRB (0.44) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713826 0.78 THRB (0.40) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL25713895 0.78 THRB (0.40) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL18353754 0.78 MAPT (0.44) THRBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL12545765 0.75 MAPT (0.62) SMN1; SMN2ALDH1A1KDM4EKMT2ATDP1

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
WO-2023120077-A1 COMPOSITION, AND PHOTOSENSITIVE COMPOSITION 東京応化工業株式会社 2023-06-29 WO disclosed