SCHEMBL11848393

SCHEMBL11848393

CN(C)CCCNc1c(N)cc(C(=O)O)cc1S(N)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ SLC12A2 P55011 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ PKM P14618 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CISD1 Q9NZ45 7/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL11845733 0.86 CA2 (0.56) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11844669 0.83 MAPT (0.57) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11837682 0.80 PTGER4 (0.55) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11855559 0.77 CA2 (0.46) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11847503 0.73 CISD1 (0.51) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11839761 0.72 PKM (0.42) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL9064672 0.69 GAA (0.44) CA2KDM4EALDH1A1LMNAHPGD
SCHEMBL11839922 0.69 MAPT (0.75) CA2KDM4EHIF1AUSP2ALDH1A1
SCHEMBL11850140 0.69 CDC25B (0.46) CA2KDM4EALDH1A1HPGDNPSR1
SCHEMBL2883310 0.69 KDM4E (0.52) CA2KDM4EHIF1AUSP2ALDH1A1

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-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US disclosed
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