SCHEMBL31316342

SCHEMBL31316342

O=C(O)C1=CC(S(=O)(=O)O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 2/20 0.39
EDNRA P25101 2/20 0.39
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
TSHR P16473 2/20 0.33
CYP1A2 P05177 1/20 0.33
TTR P02766 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL31316341 1.00 EDNRB (0.39) EDNRBEDNRAALDH1A1MAPTL3MBTL1
SCHEMBL7206513 0.87 EDNRB (0.35) EDNRBEDNRAALDH1A1MAPTL3MBTL1
SCHEMBL9296680 0.73 KMT2A (0.40) EDNRBEDNRAALDH1A1MAPTL3MBTL1
SCHEMBL27805192 0.71 EDNRB (0.37) EDNRBEDNRAALDH1A1MAPTL3MBTL1
SCHEMBL9246080 0.67
SCHEMBL11590902 0.67 IDO1 (0.40) EDNRBEDNRAALDH1A1MAPTLMNA
SCHEMBL7745983 0.66 EDNRB (0.46) EDNRBEDNRAALDH1A1MAPTL3MBTL1
SCHEMBL2319486 0.65 NCOR2 (0.42) EDNRBEDNRAMAPTLMNAKMT2A
SCHEMBL29945031 0.65 NCOR2 (0.42) EDNRBEDNRAMAPTLMNAKMT2A
SCHEMBL28531146 0.64 EDNRB (0.41) EDNRBEDNRAALDH1A1MAPTL3MBTL1

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
CN-119247531-A MIM structure optical filter and preparation method thereof 西安电子科技大学 2025-01-03 CN disclosed