SCHEMBL10823459

SCHEMBL10823459

O=C(Nc1cccc(S(=O)(=O)Nc2cccc3c(O)cc(S(=O)(=O)O)cc23)c1)Nc1cccc(S(=O)(=O)Nc2cccc3c(O)cc(S(=O)(=O)O)cc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.56
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ HTT P42858 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ CA12 O43570 4/20 0.46
▸ CA1 P00915 4/20 0.46
▸ CA2 P00918 4/20 0.46
▸ CA9 Q16790 4/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ NT5E P21589 1/20 0.44
▸ IDH1 O75874 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TIMP3 P35625 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
SCHEMBL10823698 0.91 PRMT1 (0.55) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL10823723 0.90 PRMT1 (0.52) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL10823416 0.85 MEN1 (0.49) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL10823762 0.83 EP300 (0.46) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL10823476 0.83 PRMT1 (0.62) PRMT1MEN1KMT2ANT5E
SCHEMBL10823435 0.83 KMT2A (0.52) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL10823537 0.83 PRMT1 (0.52) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL6078800 0.81 PRMT1 (0.74) PRMT1MAPTCA12CA1CA2
SCHEMBL11341928 0.81 TIMP3 (0.63) PRMT1MEN1KMT2AMAPTLMNA
SCHEMBL10823442 0.81 MEN1 (0.49) PRMT1MEN1KMT2AMAPTLMNA

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
Send feedback