SCHEMBL6079885

SCHEMBL6079885

CCOC(=O)Cc1ccc(NS(=O)(=O)c2ccc3cc(NC(=O)Nc4ccc5cc(S(=O)(=O)Nc6ccc(CC(=O)OCC)cc6)ccc5c4)ccc3c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
LMNA P02545 4/20 0.64
HSD17B10 Q99714 2/20 0.64
KDM4E B2RXH2 1/20 0.64
TSHR P16473 1/20 0.64
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
RECQL P46063 1/20 0.49
GHSR Q92847 3/20 0.47
GAA P10253 1/20 0.46
IDH1 O75874 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL6078353 0.83 CYP26A1 (0.57) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL11455802 0.79 ALDH1A1 (0.73) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL9224876 0.77 LMNA (0.70) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL6079320 0.76 PLAU (0.73) ALDH1A1LMNAKDM4ETSHRMEN1
SCHEMBL5842450 0.75 HPGD (0.63) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL6079658 0.74 GAA (0.62) ALDH1A1LMNAHSD17B10MEN1KMT2A
SCHEMBL5153509 0.73 USP2 (0.61) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL13742498 0.73 PGR (0.53) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL7791354 0.73 PLAU (0.72) ALDH1A1LMNAHSD17B10KDM4ETSHR
SCHEMBL6078852 0.73 ENPP2 (0.58) ALDH1A1LMNAMEN1KMT2ASMN1; 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 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