SCHEMBL10823683

SCHEMBL10823683

O=C(Nc1cccc(S(=O)(=O)Nc2ccc3c(O)cccc3c2S(=O)(=O)O)c1)Nc1cccc(S(=O)(=O)Nc2ccc3c(O)cccc3c2S(=O)(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PRMT1 Q99873 1/20 0.46
▸ CA12 O43570 4/20 0.45
▸ CA1 P00915 4/20 0.45
▸ CA2 P00918 4/20 0.45
▸ CA9 Q16790 4/20 0.45
▸ IDH1 O75874 2/20 0.43

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
SCHEMBL10823718 0.90 HKDC1 (0.48) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10823768 0.84 EP300 (0.46) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10823723 0.84 PRMT1 (0.52) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823528 0.84 IDH1 (0.54) MEN1KMT2AIDH1
SCHEMBL10823442 0.82 MEN1 (0.49) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823416 0.82 MEN1 (0.49) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823567 0.82 IDH1 (0.48) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823701 0.81 MEN1 (0.48) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823434 0.81 MEN1 (0.50) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL10823459 0.81 PRMT1 (0.56) MAPTMEN1KMT2ALMNAMAPK1

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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