SCHEMBL10823701

SCHEMBL10823701

O=C(Nc1cccc(S(=O)(=O)Nc2ccc(O)c3cccc(S(=O)(=O)O)c23)c1)Nc1cccc(S(=O)(=O)Nc2ccc(O)c3cccc(S(=O)(=O)O)c23)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ MAPT P10636 4/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ TIMP3 P35625 3/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ USP2 O75604 2/20 0.47
▸ RECQL P46063 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CA12 O43570 3/20 0.44
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ CA9 Q16790 3/20 0.44
▸ CHAT P28329 1/20 0.44

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
SCHEMBL10823552 0.96 MEN1 (0.51) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823562 0.92 MEN1 (0.49) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823726 0.89 PSD (0.49) MEN1KMT2AMAPTLMNATIMP3
SCHEMBL10823442 0.88 MEN1 (0.49) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823512 0.87 MEN1 (0.51) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823434 0.87 MEN1 (0.50) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823417 0.85 EP300 (0.46) MEN1KMT2AMAPTLMNAHSD17B10
SCHEMBL10823362 0.84 MEN1 (0.46) MEN1KMT2AMAPTLMNATIMP3
SCHEMBL10823729 0.84 MEN1 (0.55) MEN1KMT2AIDH1
SCHEMBL10823482 0.83 MEN1 (0.49) MEN1KMT2AMAPTLMNAMAPK1

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
US-H83-H Dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-01 — — US disclosed
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