SCHEMBL10823482

SCHEMBL10823482

O=C(Nc1cccc(S(=O)(=O)Nc2ccc3cccc(S(=O)(=O)O)c3c2O)c1)Nc1cccc(S(=O)(=O)Nc2ccc3cccc(S(=O)(=O)O)c3c2O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ MAPT P10636 5/20 0.49
▸ MAPK1 P28482 3/20 0.49
▸ LMNA P02545 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ HTT P42858 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ TTR P02766 1/20 0.44
▸ FABP4 P15090 1/20 0.44
▸ CCNA2 P20248 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ MAPK14 Q16539 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ APOBEC3G Q9HC16 1/20 0.44
▸ IDH1 O75874 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ TIMP3 P35625 1/20 0.43
▸ RECQL P46063 1/20 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
SCHEMBL10823346 0.88 CHEK1 (0.45) MEN1KMT2AMAPTLMNAHTT
SCHEMBL10823419 0.88 MAPT (0.51) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823689 0.85 MEN1 (0.46) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823717 0.84 MEN1 (0.49) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823562 0.84 MEN1 (0.49) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823701 0.83 MEN1 (0.48) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823561 0.83 PRMT1 (0.51) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823442 0.82 MEN1 (0.49) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823438 0.82 MEN1 (0.49) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL10823508 0.81 MEN1 (0.46) MEN1KMT2AMAPTMAPK1LMNA

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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