SCHEMBL10823633

SCHEMBL10823633

Cc1cc(S(=O)(=O)Nc2cc(S(=O)(=O)O)c3ccccc3c2O)ccc1NC(=O)Nc1ccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)c3ccccc3c2O)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ EP300 Q09472 1/20 0.42
▸ KAT2B Q92831 1/20 0.42
▸ KAT8 Q9H7Z6 1/20 0.42
▸ KEAP1 Q14145 2/20 0.41
▸ NFE2L2 Q16236 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HK1 P19367 2/20 0.41
▸ HKDC1 Q2TB90 2/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ TSHR P16473 2/20 0.40

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
SCHEMBL10823573 0.91 MCL1 (0.45) EP300KAT2BKAT8KEAP1NFE2L2
SCHEMBL10823622 0.90 HPSE (0.40) CA12CA1CA2CA9EP300
SCHEMBL10823574 0.87 CA12 (0.45) CA12CA1CA2CA9EP300
SCHEMBL10823370 0.85 EP300 (0.43) CA12CA1CA2CA9EP300
SCHEMBL10823454 0.85 CA12 (0.41) CA12CA1CA2CA9EP300
SCHEMBL10823538 0.84 MEN1 (0.44) CA12CA1CA2CA9EP300
SCHEMBL10823663 0.84 LMNA (0.47) EP300POLBHTTKMT2AMEN1
SCHEMBL10823738 0.83 MEN1 (0.44) CA12CA1CA2CA9EP300
SCHEMBL10823359 0.82 CA12 (0.45) CA12CA1CA2CA9EP300
SCHEMBL10823540 0.82 MEN1 (0.53) CA12CA1CA2CA9HTT

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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