SCHEMBL6080187

SCHEMBL6080187

O=C(Nc1ccc2ccc(S(=O)(=O)Nc3ccc(O)c(Cl)c3)cc2c1)Nc1ccc2ccc(S(=O)(=O)Nc3ccc(O)c(Cl)c3)cc2c1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.60
HSD17B2 P37059 1/20 0.60
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
HSD17B10 Q99714 3/20 0.51
CA2 P00918 1/20 0.50

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
SCHEMBL6077882 0.84 ALDH1A1 (0.77) MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL6078456 0.82 IDH1 (0.50) CA2
SCHEMBL29398619 0.82 IDH1 (0.50) CA2
SCHEMBL6079248 0.82 MEN1 (0.58) MEN1ALDH1A1KMT2A
SCHEMBL6078655 0.81 ALOX12 (0.45) CA2
SCHEMBL6078851 0.81 ALDH1A1 (0.62) MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL6079548 0.81 ALDH1A1 (0.59) MEN1ALDH1A1KMT2A
SCHEMBL6427772 0.81 IDH1 (0.48)
SCHEMBL6080277 0.81 PKM (0.61) HSD17B2MEN1ALDH1A1KMT2ACA2
SCHEMBL6078277 0.80 LMNA (0.67) MEN1ALDH1A1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071231-B2 Naphthalene ureas as glucose uptake enhancers TELIK, INC. (US) 2006-07-04 US disclosed
US-6458998-B1 NAPHTHALENEUREAS AS ANTIDIABETIC AGENTS TELIK, INC. 2002-10-01 US disclosed