SCHEMBL6079658

SCHEMBL6079658

O=C(Nc1ccc2cc(S(=O)(=O)Nc3ccc(C(=O)O)cc3)ccc2c1)Nc1ccc2cc(S(=O)(=O)Nc3ccc(C(=O)O)cc3)ccc2c1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.62
CYP2C9 P11712 1/20 0.60
ATIC P31939 1/20 0.60
CYP2C19 P33261 1/20 0.60
HSD17B10 Q99714 1/20 0.60
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
AKR1C3 P42330 1/20 0.58
POLB P06746 1/20 0.58
MAPT P10636 1/20 0.58
GPR27 Q9NS67 1/20 0.55
GFER P55789 1/20 0.54

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
SCHEMBL6078632 0.96 GAA (0.60) GAACYP2C9ATICCYP2C19HSD17B10
SCHEMBL6079407 0.90 WDR5 (0.59) GAACYP2C9ATICCYP2C19HSD17B10
SCHEMBL6429561 0.88 MEN1 (0.55) GAAALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL6427777 0.88 PLAU (0.66) GAACYP2C9ATICCYP2C19HSD17B10
SCHEMBL7782154 0.87 ALDH1A1 (0.77) GAACYP2C9ATICCYP2C19HSD17B10
SCHEMBL6079752 0.87 AKR1C3 (0.70) MEN1KMT2AAKR1C3POLBMAPT
SCHEMBL6079320 0.85 PLAU (0.73) GAAALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL6079195 0.85 TP53 (0.60) ALDH1A1MEN1KMT2A
SCHEMBL6077413 0.84 NPC1 (0.62) GAAALDH1A1LMNASMN1; SMN2CA2
SCHEMBL6078674 0.83 AKR1C3 (0.69) MEN1KMT2AAKR1C3POLBMAPT

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