SCHEMBL10823540

SCHEMBL10823540

O=C(Nc1cccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)c3ccccc3c2O)c1)Nc1cccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)c3ccccc3c2O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ MAPT P10636 5/20 0.53
▸ LMNA P02545 4/20 0.53
▸ MAPK1 P28482 4/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ HTT P42858 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ IDH1 O75874 2/20 0.47
▸ CA12 O43570 2/20 0.46
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ CA9 Q16790 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ PKM P14618 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MPI P34949 1/20 0.42

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
SCHEMBL10823564 0.91 MAPT (0.53) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823717 0.90 MEN1 (0.49) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823663 0.88 LMNA (0.47) MEN1KMT2ALMNAHTT
SCHEMBL10823435 0.85 KMT2A (0.52) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823670 0.85 KMT2A (0.52) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823480 0.84 MAPT (0.50) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823457 0.82 IDH1 (0.56) IDH1
SCHEMBL10823633 0.82 CA12 (0.42) MEN1KMT2ALMNAHTTCA12
SCHEMBL10823442 0.81 MEN1 (0.49) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823548 0.81 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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