SCHEMBL6077873

SCHEMBL6077873

COc1ccc(NS(=O)(=O)c2ccc3ccc(NC(=O)Nc4ccc5ccc(S(=O)(=O)Nc6ccc(OC)c(C(=O)O)c6)cc5c4)cc3c2)cc1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
LMNA P02545 5/20 0.52
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPK1 P28482 2/20 0.51
ALOX15 P16050 1/20 0.51
WDR5 P61964 1/20 0.49

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
SCHEMBL6079905 0.91 LMNA (0.60) TSHRMEN1KMT2AHTTSMN1; SMN2
SCHEMBL6078762 0.85 MEN1 (0.58) MEN1KMT2AALDH1A1
SCHEMBL6079494 0.85 CASP6 (0.59) MEN1KMT2AALDH1A1
SCHEMBL7966502 0.84 ALDH1A1 (0.67) TSHRMEN1KMT2AALDH1A1GAA
SCHEMBL6077882 0.83 ALDH1A1 (0.77) TSHRMEN1KMT2AHTTALDH1A1
SCHEMBL6429403 0.83 LMNA (0.62) MEN1KMT2AHTTSMN1; SMN2ALDH1A1
SCHEMBL6079248 0.82 MEN1 (0.58) MEN1KMT2AALDH1A1
SCHEMBL6078356 0.82 MEN1 (0.58) MEN1KMT2AALDH1A1
SCHEMBL6079098 0.82 KMT2A (0.56) MEN1KMT2AHTTSMN1; SMN2ALDH1A1
SCHEMBL6078420 0.82 PLAU (0.50) MEN1KMT2AHTTSMN1; SMN2ALDH1A1

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 3 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
EP-1181271-B1 NAPHTHALENE UREAS AS GLUCOSE UPTAKE ENHANCERS TELIK INC (US) 2005-01-19 EP disclosed
US-6458998-B1 NAPHTHALENEUREAS AS ANTIDIABETIC AGENTS TELIK, INC. 2002-10-01 US disclosed