SCHEMBL6079905

SCHEMBL6079905

COC(=O)c1cc(NS(=O)(=O)c2ccc3ccc(NC(=O)Nc4ccc5ccc(S(=O)(=O)Nc6ccc(OC)c(C(=O)OC)c6)cc5c4)cc3c2)ccc1OC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.60
ALDH1A1 P00352 1/20 0.60
GAA P10253 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPT P10636 2/20 0.55
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
PLAU P00749 2/20 0.50
TSHR P16473 1/20 0.48
OGT O15294 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL6077873 0.91 TSHR (0.59) LMNAALDH1A1GAAL3MBTL1HTT
SCHEMBL6079548 0.87 ALDH1A1 (0.59) LMNAALDH1A1GAAL3MBTL1MEN1
SCHEMBL6078420 0.86 PLAU (0.50) LMNAALDH1A1GAAL3MBTL1HTT
SCHEMBL6078277 0.86 LMNA (0.67) LMNAALDH1A1GAAL3MBTL1HTT
SCHEMBL7966502 0.84 ALDH1A1 (0.67) ALDH1A1GAAMEN1KMT2APLAU
SCHEMBL6429403 0.83 LMNA (0.62) LMNAALDH1A1GAAL3MBTL1HTT
SCHEMBL6078687 0.82 CYP2C9 (0.65) LMNAALDH1A1HTTSMN1; SMN2MEN1
SCHEMBL6078109 0.82 PLAU (0.72) LMNAALDH1A1GAAHTTSMN1; SMN2
SCHEMBL12041052 0.81 MEN1 (0.65) LMNAALDH1A1GAAL3MBTL1HTT
SCHEMBL6078794 0.81 MEN1 (0.60) LMNAALDH1A1GAAHTTSMN1; SMN2

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